0 B7R1.3 BrC1=CN=CN=C1 Z285136922 [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 BrC1=NC=CC=N1 Z415645012 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.3 BrC1=NC=CN=C1 Z415645016 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 BrC1=NN=CC=C1 Z425821176 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.3 CC1=CCCNC1 Z2143573194 [0,0,0,0,0,0|0,0,4]=4 5 B7R1.3 CC1=CN=CC=C1 Z104475010 [0,0,0,0,0,0|0,0,0]=0 6 B7R1.3 CC1=CN=NC=C1 Z1255398931 [0,0,0,0,0,0|1,0,0]=1 7 B7R1.3 CC1=NC=CC=C1 Z104472800 [0,0,0,0,0,0|2,0,0]=2 8 B7R1.3 CC1=NC=CN=C1 Z415628164 [0,0,0,0,0,0|1,0,0]=1 9 B7R1.3 CC1=NN=CC=C1 Z1245648324 [0,0,0,0,0,0|1,0,0]=1 10 B7R1.3 C[N+]1=CC=CC=C1 Z57947843 [0,0,0,0,0,0|2,0,0]=2 11 B7R1.3 ClC1=NC=CC=N1 Z104477694 [0,0,0,0,0,0|4,0,0]=4 12 B7R1.3 ClC1=NC=CN=C1 Z104490192 [0,0,0,0,0,0|2,0,0]=2 13 B7R1.3 ClC1=NC=NC=C1 Z1962223597 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 ClC1=NN=CC=C1 Z3225948108 [0,0,0,0,0,0|2,0,0]=2 15 B7R1.3 IC1=CN=CN=C1 Z1259106172 [0,0,0,0,0,0|2,0,0]=2 16 B7R1.3 IC1=NC=CN=C1 Z1235940810 [0,0,0,0,0,0|2,0,0]=2 17 B7R1.3 NC1=CC=CC=C1 Z2301541997 [0,0,0,0,0,0|2,0,0]=2 18 B7R1.3 NC1=CC=NC=C1 Z104495272 [0,0,0,0,0,0|3,0,0]=3 19 B7R1.3 NC1=CN=CC=C1 Z104494800 [0,0,0,0,0,0|1,0,0]=1 20 B7R1.3 NC1=CN=CN=C1 Z800187814 [0,0,0,0,0,0|2,0,0]=2 21 B7R1.3 NC1=NC=CC=C1 Z104472278 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.3 NC1=NC=CC=N1 Z2895177097 [0,0,0,0,0,0|4,0,0]=4 23 B7R1.3 NC1=NC=CN=C1 Z56899063 [0,0,0,0,0,0|2,0,0]=2 24 B7R1.3 NC1=NC=NC=C1 Z3244659415 [0,0,0,0,0,0|4,0,0]=4 25 B7R1.3 NC1=NC=NN=C1 Z1203581736 [0,0,0,0,0,0|3,0,0]=3 26 B7R1.3 NC1=NN=CC=C1 Z991531024 [0,0,0,0,0,0|2,0,0]=2 27 B7R1.3 NC1=NN=CC=N1 Z104477884 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.3 N[N+]1=CC=CC=C1 Z56872220 [0,0,0,0,0,0|3,0,0]=3 29 B7R1.3 O=C1C=CC=CN1 Z1245646663 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.3 O=C1C=CC=NN1 Z803153778 [0,0,0,0,0,0|2,0,0]=2 31 B7R1.3 O=C1C=CCCC1 Z295197140 [0,0,0,0,0,0|2,0,2]=4 32 B7R1.3 O=C1C=CCCO1 Z1255402681 [0,0,0,0,0,0|3,0,1]=4 33 B7R1.3 O=C1C=COC=C1 Z586248016 [0,0,0,0,0,0|3,0,0]=3 34 B7R1.3 O=C1C=NC=CN1 Z3225868124 [0,0,0,0,0,0|2,0,0]=2 35 B7R1.3 O=C1N=CC=CN1 Z1201023052 [0,0,0,0,0,0|4,0,0]=4 36 B7R1.3 OC1=CC=CC=C1 Z104473830 [0,0,0,0,0,0|2,0,0]=2 37 B7R1.3 OC1=CN=CC=C1 Z104476790 [0,0,0,0,0,0|1,0,0]=1 38 B7R1.3 OC1=CN=CN=C1 Z1116372083 [0,0,0,0,0,0|2,0,0]=2 39 B7R1.3 OC1=CN=NC=C1 Z2235790619 [0,0,0,0,0,0|2,0,0]=2 40 B7R1.3 OC1=NC=NC=C1 Z314605438 [0,0,0,0,0,0|4,0,0]=4 41 B7R1.3 S=C1C=CNC=N1 Z1258992452 [0,0,0,0,0,0|4,0,0]=4 42 B7R1.3 SC1=NC=CC=C1 Z203045372 [0,0,0,0,0,0|3,0,0]=3 43 B7R1.3 SC1=NC=CC=N1 Z87001196 [0,0,0,0,0,0|4,0,0]=4 44 B7R1.3 SC1=NC=CN=C1 Z239089534 [0,0,0,0,0,0|2,0,0]=2 45 B6R1.1 C1=CC=CC=C1 Z57120059 [1,0,0,0,0,0|1,0,0]=2 46 B6R1.1 C1=CC=NC=C1 Z56899837 [1,0,0,0,0,0|0,0,0]=1 47 B8R1.2 C#CC1=CN=CN=C1 Z1080385536 [0,1,0,0,0,0|1,0,1]=3 48 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [0,1,0,0,0,0|1,0,1]=3 49 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [0,1,0,0,0,0|2,0,1]=4 50 B8R1.2 CCC1=CC=CC=C1 Z104473632 [0,1,0,0,0,0|1,0,0]=2 51 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [0,1,0,0,0,0|2,0,0]=3 52 B8R1.2 CCC1=CN=CC=C1 Z104476778 [0,1,0,0,0,0|0,0,0]=1 53 B8R1.2 CCC1=NC=CC=C1 Z113558650 [0,1,0,0,0,0|2,0,0]=3 54 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [0,1,0,0,0,0|3,0,0]=4 55 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [0,1,0,0,0,0|3,0,0]=4 56 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [0,1,0,0,0,0|1,0,0]=2 57 B8R1.2 CNC1=CC=CC=C1 Z104472478 [0,1,0,0,0,0|1,0,0]=2 58 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [0,1,0,0,0,0|0,0,0]=1 59 B8R1.2 CNC1=NC=CC=N1 Z54628578 [0,1,0,0,0,0|3,0,0]=4 60 B8R1.2 CNC1=NC=NC=C1 Z800212728 [0,1,0,0,0,0|3,0,0]=4 61 B8R1.2 CNC1=NN=CC=C1 Z991530894 [0,1,0,0,0,0|1,0,0]=2 62 B8R1.2 CNC1=NN=CC=N1 Z1198323671 [0,1,0,0,0,0|2,0,0]=3 63 B8R1.2 COC1=CC=CC=C1 Z53833865 [0,1,0,0,0,0|1,0,0]=2 64 B8R1.2 CSC1=CC=NC=C1 Z1376456468 [0,1,0,0,0,0|2,0,0]=3 65 B8R1.2 CSC1=NC=CN=C1 Z1203162104 [0,1,0,0,0,0|1,0,0]=2 66 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [0,1,0,0,0,0|2,0,0]=3 67 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [0,1,0,0,0,0|1,0,1]=3 68 B8R1.2 N#CC1=CC=NC=C1 Z57899720 [0,1,0,0,0,0|2,0,1]=4 69 B8R1.2 N#CC1=CN=CC=C1 Z57899719 [0,1,0,0,0,0|0,0,1]=2 70 B8R1.2 N#CC1=CN=CN=C1 Z1201619938 [0,1,0,0,0,0|1,0,1]=3 71 B8R1.2 N#CC1=NC=CN=C1 Z448103898 [0,1,0,0,0,0|1,0,1]=3 72 B8R1.2 N#CC1=NN=CC=C1 Z1198236174 [0,1,0,0,0,0|1,0,1]=3 73 B8R1.2 NCC1=CC=CC=C1 Z54748260 [0,1,0,0,0,0|1,0,0]=2 74 B8R1.2 NCC1=CC=NC=C1 Z104474354 [0,1,0,0,0,0|2,0,0]=3 75 B8R1.2 NCC1=CN=CC=C1 Z104474366 [0,1,0,0,0,0|0,0,0]=1 76 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [0,1,0,0,0,0|1,0,0]=2 77 B8R1.2 NCC1=NC=CC=C1 Z104474352 [0,1,0,0,0,0|2,0,0]=3 78 B8R1.2 NCC1=NC=CC=N1 Z1463350843 [0,1,0,0,0,0|3,0,0]=4 79 B8R1.2 NCC1=NC=CN=C1 Z241059702 [0,1,0,0,0,0|1,0,0]=2 80 B8R1.2 NCC1=NC=NC=C1 Z254526552 [0,1,0,0,0,0|3,0,0]=4 81 B8R1.2 NCC1=NN=CC=C1 Z1198165902 [0,1,0,0,0,0|1,0,0]=2 82 B8R1.2 NNC1=CC=CC=C1 Z104472442 [0,1,0,0,0,0|2,0,0]=3 83 B8R1.2 NNC1=NC=CC=C1 Z56887722 [0,1,0,0,0,0|3,0,0]=4 84 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [0,1,0,0,0,0|2,0,1]=4 85 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [0,1,0,0,0,0|0,0,1]=2 86 B8R1.2 O=CC1=CN=CN=C1 Z1013450426 [0,1,0,0,0,0|1,0,1]=3 87 B8R1.2 O=CC1=CN=NC=C1 Z1255435509 [0,1,0,0,0,0|1,0,1]=3 88 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [0,1,0,0,0,0|2,0,1]=4 89 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [0,1,0,0,0,0|1,0,1]=3 90 B8R1.2 O=CC1=NN=CC=C1 Z1198165301 [0,1,0,0,0,0|1,0,1]=3 91 B8R1.2 OCC1=CC=CC=C1 Z104476418 [0,1,0,0,0,0|1,0,0]=2 92 B8R1.2 OCC1=CC=NC=C1 Z335244866 [0,1,0,0,0,0|2,0,0]=3 93 B8R1.2 OCC1=CN=CC=C1 Z104495622 [0,1,0,0,0,0|0,0,0]=1 94 B8R1.2 OCC1=NC=CC=C1 Z57921252 [0,1,0,0,0,0|2,0,0]=3 95 B8R1.3 BrC1=CC=C(C=C1)Br Z104474572 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.3 BrC1=CC=C(C=C1)I Z299596184 [0,1,0,0,0,0|2,0,0]=3 97 B8R1.3 BrC1=CN=C(C=C1)I Z1269172302 [0,1,0,0,0,0|1,0,0]=2 98 B8R1.3 BrC1=CN=C(N=C1)I Z1192044953 [0,1,0,0,0,0|2,0,0]=3 99 B8R1.3 CC1=CC=C(C=C1)C Z199056432 [0,1,0,0,0,0|1,0,0]=2 100 B8R1.3 CC1=CC=C(C=C1)Cl Z56924546 [0,1,0,0,0,0|1,0,0]=2 101 B8R1.3 CC1=CC=C(C=C1)F Z104473648 [0,1,0,0,0,0|1,0,0]=2 102 B8R1.3 CC1=CC=C(C=C1)N Z57127875 [0,1,0,0,0,0|1,0,0]=2 103 B8R1.3 CC1=CC=C(C=C1)O Z104473818 [0,1,0,0,0,0|1,0,0]=2 104 B8R1.3 CC1=CN=C(C=C1)Br Z415645054 [0,1,0,0,0,0|0,0,0]=1 105 B8R1.3 CC1=CN=C(C=C1)N Z104475374 [0,1,0,0,0,0|0,0,0]=1 106 B8R1.3 CC1=CN=C(C=C1)O Z1255523405 [0,1,0,0,0,0|0,0,0]=1 107 B8R1.3 CC1=CN=C(C=C1)S Z271138132 [0,1,0,0,0,0|0,0,0]=1 108 B8R1.3 CC1=CN=C(N=C1)Br Z1098236936 [0,1,0,0,0,0|1,0,0]=2 109 B8R1.3 CC1=CN=C(N=C1)Cl Z1098236276 [0,1,0,0,0,0|1,0,0]=2 110 B8R1.3 CC1=CN=C(N=C1)F Z1198266630 [0,1,0,0,0,0|1,0,0]=2 111 B8R1.3 CC1=CN=C(N=C1)N Z801565598 [0,1,0,0,0,0|1,0,0]=2 112 B8R1.3 CC1=CN=C(N=C1)S Z1868163321 [0,1,0,0,0,0|1,0,0]=2 113 B8R1.3 CC1=CNC(=O)N=C1 Z1098236277 [0,1,0,0,0,0|1,0,0]=2 114 B8R1.3 CC1=NC=C(C=C1)N Z425834586 [0,1,0,0,0,0|1,0,0]=2 115 B8R1.3 CC1=NC=C(C=C1)O Z838078132 [0,1,0,0,0,0|1,0,0]=2 116 B8R1.3 CC1=NC=C(N=C1)Br Z1198181968 [0,1,0,0,0,0|1,0,0]=2 117 B8R1.3 CC1=NC=C(N=C1)Cl Z1198149378 [0,1,0,0,0,0|1,0,0]=2 118 B8R1.3 CC1=NC=C(N=C1)N Z1198177429 [0,1,0,0,0,0|1,0,0]=2 119 B8R1.3 CC1=NN=C(C=C1)Br Z802822146 [0,1,0,0,0,0|1,0,0]=2 120 B8R1.3 CC1=NN=C(C=C1)Cl Z432063474 [0,1,0,0,0,0|1,0,0]=2 121 B8R1.3 CC1=NN=C(C=C1)F Z1251352426 [0,1,0,0,0,0|1,0,0]=2 122 B8R1.3 CC1=NN=C(C=C1)I Z1209436744 [0,1,0,0,0,0|1,0,0]=2 123 B8R1.3 CC1=NN=C(N=C1)N Z1203578846 [0,1,0,0,0,0|2,0,0]=3 124 B8R1.3 CC1=NNC(=O)C=C1 Z1201023044 [0,1,0,0,0,0|1,0,1]=3 125 B8R1.3 ClC1=CC=C(C=C1)Cl Z104476304 [0,1,0,0,0,0|2,0,0]=3 126 B8R1.3 ClC1=CN=C(C=C1)Br Z415645024 [0,1,0,0,0,0|1,0,0]=2 127 B8R1.3 ClC1=CN=C(C=N1)Cl Z1198164590 [0,1,0,0,0,0|2,0,0]=3 128 B8R1.3 ClC1=CN=C(N=C1)Br Z1198342885 [0,1,0,0,0,0|2,0,0]=3 129 B8R1.3 ClC1=CN=C(N=C1)Cl Z1198154633 [0,1,0,0,0,0|2,0,0]=3 130 B8R1.3 ClC1=NC=C(C=C1)Br Z239604476 [0,1,0,0,0,0|1,0,0]=2 131 B8R1.3 ClC1=NC=C(C=N1)Br Z1079244864 [0,1,0,0,0,0|2,0,0]=3 132 B8R1.3 ClC1=NC=C(C=N1)I Z1124375877 [0,1,0,0,0,0|2,0,0]=3 133 B8R1.3 ClC1=NC=C(N=C1)Br Z1198179757 [0,1,0,0,0,0|2,0,0]=3 134 B8R1.3 ClC1=NC=C(N=C1)I Z1269194601 [0,1,0,0,0,0|2,0,0]=3 135 B8R1.3 ClC1=NN=C(C=C1)Br Z1198233188 [0,1,0,0,0,0|2,0,0]=3 136 B8R1.3 ClC1=NN=C(C=C1)Cl Z57033933 [0,1,0,0,0,0|2,0,0]=3 137 B8R1.3 ClC1=NN=C(C=C1)I Z1269245018 [0,1,0,0,0,0|2,0,0]=3 138 B8R1.3 FC1=CN=C(C=C1)Cl Z1238544557 [0,1,0,0,0,0|1,0,0]=2 139 B8R1.3 FC1=CN=C(N=C1)Cl Z1255465697 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.3 FC1=NC=C(C=C1)Br Z977035742 [0,1,0,0,0,0|1,0,0]=2 141 B8R1.3 FC1=NC=C(C=N1)Cl Z1255462882 [0,1,0,0,0,0|2,0,0]=3 142 B8R1.3 FC1=NC=C(N=C1)Cl Z1198220735 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.3 FC1=NN=C(C=C1)Cl Z1618110321 [0,1,0,0,0,0|2,0,0]=3 144 B8R1.3 NC1=CC=C(C=C1)Cl Z104472774 [0,1,0,0,0,0|2,0,0]=3 145 B8R1.3 NC1=CC=C(C=C1)F Z57127563 [0,1,0,0,0,0|2,0,0]=3 146 B8R1.3 NC1=CC=C(C=C1)I Z57127369 [0,1,0,0,0,0|2,0,0]=3 147 B8R1.3 NC1=CC=C(C=C1)N Z104472524 [0,1,0,0,0,0|2,0,0]=3 148 B8R1.3 NC1=CC=C(C=C1)O Z57127517 [0,1,0,0,0,0|2,0,0]=3 149 B8R1.3 NC1=CN=C(C=C1)Cl Z335436282 [0,1,0,0,0,0|1,0,0]=2 150 B8R1.3 NC1=CN=C(C=C1)I Z56788762 [0,1,0,0,0,0|1,0,0]=2 151 B8R1.3 NC1=CN=C(C=C1)N Z385438796 [0,1,0,0,0,0|1,0,0]=2 152 B8R1.3 NC1=CN=C(C=C1)O Z385458150 [0,1,0,0,0,0|1,0,0]=2 153 B8R1.3 NC1=CN=C(N=C1)N Z362768106 [0,1,0,0,0,0|2,0,0]=3 154 B8R1.3 NC1=NC=C(C=C1)Br Z57073814 [0,1,0,0,0,0|1,0,0]=2 155 B8R1.3 NC1=NC=C(C=C1)Cl Z104475596 [0,1,0,0,0,0|1,0,0]=2 156 B8R1.3 NC1=NC=C(C=C1)F Z223120142 [0,1,0,0,0,0|1,0,0]=2 157 B8R1.3 NC1=NC=C(C=N1)Br Z729558264 [0,1,0,0,0,0|2,0,0]=3 158 B8R1.3 NC1=NC=C(C=N1)F Z1203579458 [0,1,0,0,0,0|2,0,0]=3 159 B8R1.3 NC1=NC=C(C=N1)I Z1269125822 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.3 NC1=NC=C(C=N1)O Z1198175903 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.3 NC1=NN=C(C=C1)Cl Z56973924 [0,1,0,0,0,0|2,0,0]=3 162 B8R1.3 NC1=NNC(=O)C=C1 Z1723418911 [0,1,0,0,0,0|2,0,0]=3 163 B8R1.3 O=C1C=CC(=CN1)Br Z271004874 [0,1,0,0,0,0|1,0,1]=3 164 B8R1.3 O=C1C=CC(=O)C=C1 Z104474802 [0,1,0,0,0,0|2,0,0]=3 165 B8R1.3 O=C1C=CC(=O)NN1 Z57032544 [0,1,0,0,0,0|2,0,1]=4 166 B8R1.3 O=C1N=CC(=CN1)I Z2471547918 [0,1,0,0,0,0|2,0,0]=3 167 B8R1.3 OC1=CC=C(C=C1)Br Z57127362 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.3 OC1=CC=C(C=C1)Cl Z104473434 [0,1,0,0,0,0|2,0,0]=3 169 B8R1.3 OC1=CC=C(C=C1)I Z104496300 [0,1,0,0,0,0|2,0,0]=3 170 B8R1.3 OC1=CC=C(C=C1)O Z57127551 [0,1,0,0,0,0|2,0,0]=3 171 B8R1.3 OC1=CN=C(C=C1)Br Z1201622821 [0,1,0,0,0,0|1,0,0]=2 172 B8R1.3 OC1=CN=C(C=C1)I Z1269183606 [0,1,0,0,0,0|1,0,0]=2 173 B8R1.3 OC1=CN=C(C=C1)O Z1198152559 [0,1,0,0,0,0|1,0,0]=2 174 B8R1.3 OC1=NC=C(C=C1)Cl Z2235409237 [0,1,0,0,0,0|1,0,0]=2 175 B8R1.3 OC1=NC=C(C=C1)F Z594267896 [0,1,0,0,0,0|1,0,0]=2 176 B8R1.3 OC1=NC=C(C=C1)I Z1269227573 [0,1,0,0,0,0|1,0,0]=2 177 B8R1.3 SC1=CC=C(C=C1)Cl Z57834219 [0,1,0,0,0,0|2,0,0]=3 178 B8R1.3 SC1=NC=C(C=C1)Cl Z271138142 [0,1,0,0,0,0|1,0,0]=2 179 B8R1.4 BrC1=CC(=CC=C1)I Z381540820 [0,1,0,0,0,0|2,0,0]=3 180 B8R1.4 BrC1=CC(=CN=C1)I Z1269188472 [0,1,0,0,0,0|1,0,0]=2 181 B8R1.4 BrC1=CN=CC(=C1)Br Z57070461 [0,1,0,0,0,0|1,0,0]=2 182 B8R1.4 CC1=CC(=CC=C1)F Z104474044 [0,1,0,0,0,0|1,0,0]=2 183 B8R1.4 CC1=CC(=CC=C1)N Z57127904 [0,1,0,0,0,0|1,0,0]=2 184 B8R1.4 CC1=CC(=CC=C1)O Z104473820 [0,1,0,0,0,0|1,0,0]=2 185 B8R1.4 CC1=CC(=CN=C1)Br Z1255461727 [0,1,0,0,0,0|0,0,0]=1 186 B8R1.4 CC1=CC(=NC=C1)Br Z851792570 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.4 CC1=CC(=NC=C1)N Z203045032 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.4 CC1=CC(=NC=C1)S Z851791760 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.4 CC1=CC(=NN=C1)Cl Z1201625142 [0,1,0,0,0,0|1,0,0]=2 190 B8R1.4 CC1=CC(=NN=C1)N Z1198278271 [0,1,0,0,0,0|1,0,0]=2 191 B8R1.4 CC1=CC(=NN=C1)O Z1198278270 [0,1,0,0,0,0|1,0,0]=2 192 B8R1.4 CC1=CC(=O)CCC1 Z1042078386 [0,1,0,0,0,0|1,0,2]=4 193 B8R1.4 CC1=CC(=O)NC=C1 Z1065655286 [0,1,0,0,0,0|2,0,0]=3 194 B8R1.4 CC1=CC=CC(=C1)C Z199056430 [0,1,0,0,0,0|1,0,0]=2 195 B8R1.4 CC1=CC=CC(=N1)C Z104472820 [0,1,0,0,0,0|2,0,0]=3 196 B8R1.4 CC1=CC=CC(=O)N1 Z600389900 [0,1,0,0,0,0|2,0,0]=3 197 B8R1.4 CC1=NC(=CC=C1)Br Z600403652 [0,1,0,0,0,0|2,0,0]=3 198 B8R1.4 CC1=NC(=CC=C1)N Z104476000 [0,1,0,0,0,0|2,0,0]=3 199 B8R1.4 CC1=NC(=CC=N1)Br Z1013760006 [0,1,0,0,0,0|3,0,0]=4 200 B8R1.4 CC1=NC(=CC=N1)Cl Z445153084 [0,1,0,0,0,0|3,0,0]=4 201 B8R1.4 CC1=NC(=CN=C1)Br Z1255361267 [0,1,0,0,0,0|1,0,0]=2 202 B8R1.4 CC1=NC(=CN=C1)Cl Z1162448376 [0,1,0,0,0,0|1,0,0]=2 203 B8R1.4 CC1=NC(=CN=C1)F Z1862003526 [0,1,0,0,0,0|1,0,0]=2 204 B8R1.4 CC1=NC(=CN=C1)N Z1203578408 [0,1,0,0,0,0|1,0,0]=2 205 B8R1.4 CC1=NC(=N)C=CN1 Z2092177023 [0,1,0,0,0,0|3,0,0]=4 206 B8R1.4 CC1=NC(=NC=C1)Br Z1065587482 [0,1,0,0,0,0|3,0,0]=4 207 B8R1.4 CC1=NC(=NC=C1)Cl Z1065586248 [0,1,0,0,0,0|3,0,0]=4 208 B8R1.4 CC1=NC(=NC=C1)N Z104500640 [0,1,0,0,0,0|3,0,0]=4 209 B8R1.4 CC1=NC(=NN=C1)N Z381019664 [0,1,0,0,0,0|2,0,0]=3 210 B8R1.4 CC1=NC(=O)C=CN1 Z1269638492 [0,1,0,0,0,0|3,0,0]=4 211 B8R1.4 CC1=NC(=O)NC=C1 Z1065584884 [0,1,0,0,0,0|3,0,0]=4 212 B8R1.4 CC1=NC=CC(=C1)[S-] Z3014227847 [0,1,0,0,0,0|2,0,0]=3 213 B8R1.4 CC1=NC=NC(=C1)Br Z787349642 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.4 CC1=NC=NC(=C1)Cl Z787326738 [0,1,0,0,0,0|3,0,0]=4 215 B8R1.4 CC1=NC=NC(=C1)N Z787349196 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.4 CC1=NC=NC(=C1)O Z314661966 [0,1,0,0,0,0|3,0,0]=4 217 B8R1.4 CC1=NN=CC(=C1)N Z2462827969 [0,1,0,0,0,0|1,0,0]=2 218 B8R1.4 ClC1=CC(=CC=C1)I Z381540752 [0,1,0,0,0,0|2,0,0]=3 219 B8R1.4 ClC1=CC(=NN=C1)Cl Z1198278268 [0,1,0,0,0,0|2,0,0]=3 220 B8R1.4 ClC1=CN=CC(=N1)Cl Z217291786 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.4 ClC1=NC=CC(=C1)Br Z1255461858 [0,1,0,0,0,0|3,0,0]=4 222 B8R1.4 FC1=CC(=CN=C1)I Z1269109329 [0,1,0,0,0,0|1,0,0]=2 223 B8R1.4 FC1=CC(=NN=C1)Cl Z4047446131 [0,1,0,0,0,0|2,0,0]=3 224 B8R1.4 FC1=NC(=CN=C1)Cl Z1255444361 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.4 NC1=CC(=CC=C1)Br Z104472516 [0,1,0,0,0,0|2,0,0]=3 226 B8R1.4 NC1=CC(=CC=C1)I Z104477944 [0,1,0,0,0,0|2,0,0]=3 227 B8R1.4 NC1=CC(=CC=C1)O Z104473438 [0,1,0,0,0,0|2,0,0]=3 228 B8R1.4 NC1=CC(=CN=C1)Cl Z2830704581 [0,1,0,0,0,0|1,0,0]=2 229 B8R1.4 NC1=CC(=CN=C1)F Z1201619910 [0,1,0,0,0,0|1,0,0]=2 230 B8R1.4 NC1=CC(=NC=C1)Cl Z217306542 [0,1,0,0,0,0|3,0,0]=4 231 B8R1.4 NC1=CC(=NC=C1)N Z851810344 [0,1,0,0,0,0|3,0,0]=4 232 B8R1.4 NC1=CC(=NC=C1)O Z851811376 [0,1,0,0,0,0|3,0,0]=4 233 B8R1.4 NC1=CC(=O)NN=C1 Z1198330189 [0,1,0,0,0,0|2,0,0]=3 234 B8R1.4 NC1=CC=CC(=N1)N Z104495224 [0,1,0,0,0,0|3,0,0]=4 235 B8R1.4 NC1=CN=CC(=C1)N Z3158827045 [0,1,0,0,0,0|1,0,0]=2 236 B8R1.4 NC1=CN=CC(=O)N1 Z2756879989 [0,1,0,0,0,0|2,0,0]=3 237 B8R1.4 NC1=NC(=CC=C1)Br Z425864750 [0,1,0,0,0,0|3,0,0]=4 238 B8R1.4 NC1=NC(=CN=C1)Cl Z850999210 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.4 NC1=NC(=O)C=NN1 Z1203579074 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.4 NC1=NC=CC(=C1)F Z2513334082 [0,1,0,0,0,0|3,0,0]=4 241 B8R1.4 NC1=NC=CC(=C1)O Z1198164201 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.4 O=C1C=C(C=NN1)O Z1198169122 [0,1,0,0,0,0|2,0,0]=3 243 B8R1.4 O=C1C=COC(=C1)O Z1198306031 [0,1,0,0,0,0|3,0,0]=4 244 B8R1.4 O=C1C=NNC(=N1)S Z2867502109 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.4 O=C1C=NNC(=O)N1 Z276509088 [0,1,0,0,0,0|3,0,0]=4 246 B8R1.4 OC1=CC(=CC=C1)Br Z104473834 [0,1,0,0,0,0|2,0,0]=3 247 B8R1.4 OC1=CC(=CC=C1)Cl Z104473668 [0,1,0,0,0,0|2,0,0]=3 248 B8R1.4 OC1=CC(=CC=C1)I Z104485566 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.4 OC1=CC(=CN=C1)Br Z1172207821 [0,1,0,0,0,0|1,0,0]=2 250 B8R1.4 OC1=CC(=CN=C1)I Z1269207182 [0,1,0,0,0,0|1,0,0]=2 251 B8R1.4 OC1=CC(=NC=C1)O Z3225946514 [0,1,0,0,0,0|3,0,0]=4 252 B8R1.4 OC1=CC=CC(=C1)O Z104474576 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.4 OC1=CN=CC(=C1)O Z1198158915 [0,1,0,0,0,0|1,0,0]=2 254 B8R1.4 [O-][N+]1=CC(=NC=C1)Cl Z1255465409 [0,1,0,0,0,0|2,0,1]=4 255 B8R1.5 BrC1=C(C=CN=C1)I Z1269120686 [0,1,0,0,0,0|1,0,0]=2 256 B8R1.5 CC1=C(C=CC=C1)C Z212053190 [0,1,0,0,0,0|1,0,0]=2 257 B8R1.5 CC1=C(C=CC=C1)F Z104474026 [0,1,0,0,0,0|1,0,0]=2 258 B8R1.5 CC1=C(C=CC=C1)N Z57127943 [0,1,0,0,0,0|1,0,0]=2 259 B8R1.5 CC1=C(C=CC=C1)O Z104473822 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.5 CC1=C(C=CC=N1)I Z1269190410 [0,1,0,0,0,0|1,0,0]=2 261 B8R1.5 CC1=C(C=CN=C1)Br Z1201621264 [0,1,0,0,0,0|0,0,0]=1 262 B8R1.5 CC1=C(C=CN=N1)N Z1964347676 [0,1,0,0,0,0|1,0,0]=2 263 B8R1.5 CC1=C(C=NC=C1)Br Z1255379175 [0,1,0,0,0,0|1,0,0]=2 264 B8R1.5 CC1=C(C=NC=C1)N Z625801040 [0,1,0,0,0,0|1,0,0]=2 265 B8R1.5 CC1=C(C=NN=C1)N Z1203587249 [0,1,0,0,0,0|1,0,0]=2 266 B8R1.5 CC1=C(N=CC=C1)Br Z968908232 [0,1,0,0,0,0|0,0,0]=1 267 B8R1.5 CC1=C(N=CC=C1)C Z104472816 [0,1,0,0,0,0|0,0,0]=1 268 B8R1.5 CC1=C(N=CC=C1)N Z203045034 [0,1,0,0,0,0|0,0,0]=1 269 B8R1.5 CC1=C(N=CC=C1)S Z968907338 [0,1,0,0,0,0|0,0,0]=1 270 B8R1.5 CC1=C(N=CC=N1)Br Z1198181977 [0,1,0,0,0,0|1,0,0]=2 271 B8R1.5 CC1=C(N=CC=N1)C Z448248230 [0,1,0,0,0,0|1,0,0]=2 272 B8R1.5 CC1=C(N=CC=N1)Cl Z1198147877 [0,1,0,0,0,0|1,0,0]=2 273 B8R1.5 CC1=C(N=CC=N1)F Z1551948468 [0,1,0,0,0,0|1,0,0]=2 274 B8R1.5 CC1=C(N=CC=N1)N Z3068686273 [0,1,0,0,0,0|1,0,0]=2 275 B8R1.5 CC1=C(N=CC=N1)O Z1198157257 [0,1,0,0,0,0|1,0,0]=2 276 B8R1.5 CC1=C(N=CN=C1)C Z2760929781 [0,1,0,0,0,0|1,0,0]=2 277 B8R1.5 CC1=C(N=CN=C1)Cl Z1198176691 [0,1,0,0,0,0|1,0,0]=2 278 B8R1.5 CC1=C(N=NC=C1)Cl Z1198179855 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.5 CC1=CC=CNC1=O Z1013766914 [0,1,0,0,0,0|0,0,1]=2 280 B8R1.5 CC1=CC=NNC1=O Z3227035121 [0,1,0,0,0,0|1,0,1]=3 281 B8R1.5 CC1=CNC=CC1=N Z1263529539 [0,1,0,0,0,0|0,0,1]=2 282 B8R1.5 CC1=[N+](C=CC=C1)C Z56791140 [0,1,0,0,0,0|2,0,0]=3 283 B8R1.5 CC1=[N+](C=CC=C1)N Z57931449 [0,1,0,0,0,0|2,0,0]=3 284 B8R1.5 CN1C=CC=CC1=S Z56928900 [0,1,0,0,0,0|2,0,0]=3 285 B8R1.5 CN1C=CC=NC1=O Z1198218328 [0,1,0,0,0,0|1,0,0]=2 286 B8R1.5 C[N+]1=C(C=CC=C1)Br Z56756330 [0,1,0,0,0,0|2,0,0]=3 287 B8R1.5 C[N+]1=C(C=CC=C1)Cl Z104501460 [0,1,0,0,0,0|2,0,0]=3 288 B8R1.5 C[N+]1=C(C=CC=C1)N Z56872249 [0,1,0,0,0,0|2,0,0]=3 289 B8R1.5 ClC1=C(C=CC=C1)Cl Z104473644 [0,1,0,0,0,0|2,0,0]=3 290 B8R1.5 ClC1=C(C=CC=N1)Br Z808600354 [0,1,0,0,0,0|1,0,0]=2 291 B8R1.5 ClC1=C(C=NC=C1)Cl Z1575308475 [0,1,0,0,0,0|1,0,0]=2 292 B8R1.5 ClC1=C(C=NC=N1)Br Z1079255426 [0,1,0,0,0,0|2,0,0]=3 293 B8R1.5 ClC1=C(C=NC=N1)I Z1079458538 [0,1,0,0,0,0|2,0,0]=3 294 B8R1.5 ClC1=C(N=CC=C1)Br Z415645050 [0,1,0,0,0,0|1,0,0]=2 295 B8R1.5 ClC1=C(N=CC=C1)Cl Z164708870 [0,1,0,0,0,0|1,0,0]=2 296 B8R1.5 ClC1=C(N=CC=N1)Br Z1255362476 [0,1,0,0,0,0|2,0,0]=3 297 B8R1.5 ClC1=C(N=CC=N1)Cl Z850504018 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.5 ClC1=C(N=CC=N1)I Z1813099369 [0,1,0,0,0,0|2,0,0]=3 299 B8R1.5 ClC1=C(N=CN=C1)Cl Z1198221914 [0,1,0,0,0,0|2,0,0]=3 300 B8R1.5 FC1=C(C=CC=C1)Br Z756953644 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.5 FC1=C(C=CC=C1)F Z104473256 [0,1,0,0,0,0|2,0,0]=3 302 B8R1.5 FC1=C(C=CC=N1)I Z1238548161 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.5 FC1=C(C=CN=C1)I Z1269153298 [0,1,0,0,0,0|1,0,0]=2 304 B8R1.5 FC1=C(N=CC=C1)Br Z997724396 [0,1,0,0,0,0|1,0,0]=2 305 B8R1.5 FC1=C(N=CC=C1)Cl Z850328566 [0,1,0,0,0,0|1,0,0]=2 306 B8R1.5 FC1=C(N=CC=N1)Cl Z1551935456 [0,1,0,0,0,0|2,0,0]=3 307 B8R1.5 FC1=C(N=CN=C1)Cl Z1201625151 [0,1,0,0,0,0|2,0,0]=3 308 B8R1.5 NC1=C(C=CC=C1)Br Z104472512 [0,1,0,0,0,0|2,0,0]=3 309 B8R1.5 NC1=C(C=CC=C1)F Z104474198 [0,1,0,0,0,0|2,0,0]=3 310 B8R1.5 NC1=C(C=CC=C1)I Z104472778 [0,1,0,0,0,0|2,0,0]=3 311 B8R1.5 NC1=C(C=CC=C1)N Z104472742 [0,1,0,0,0,0|2,0,0]=3 312 B8R1.5 NC1=C(C=CC=C1)O Z57127952 [0,1,0,0,0,0|2,0,0]=3 313 B8R1.5 NC1=C(C=CC=N1)I Z363805876 [0,1,0,0,0,0|1,0,0]=2 314 B8R1.5 NC1=C(C=CC=N1)O Z104495292 [0,1,0,0,0,0|1,0,0]=2 315 B8R1.5 NC1=C(C=CN=C1)Cl Z1198095644 [0,1,0,0,0,0|1,0,0]=2 316 B8R1.5 NC1=C(C=CN=C1)O Z370653926 [0,1,0,0,0,0|1,0,0]=2 317 B8R1.5 NC1=C(C=NC=C1)Cl Z56914824 [0,1,0,0,0,0|1,0,0]=2 318 B8R1.5 NC1=C(C=NC=C1)N Z385438794 [0,1,0,0,0,0|1,0,0]=2 319 B8R1.5 NC1=C(C=NC=C1)O Z1664348606 [0,1,0,0,0,0|1,0,0]=2 320 B8R1.5 NC1=C(C=NC=N1)Br Z1198152536 [0,1,0,0,0,0|2,0,0]=3 321 B8R1.5 NC1=C(C=NC=N1)F Z1255487690 [0,1,0,0,0,0|2,0,0]=3 322 B8R1.5 NC1=C(N=CC=C1)Cl Z104475710 [0,1,0,0,0,0|1,0,0]=2 323 B8R1.5 NC1=C(N=CC=C1)N Z385438806 [0,1,0,0,0,0|1,0,0]=2 324 B8R1.5 NC1=C(N=CC=C1)O Z969560564 [0,1,0,0,0,0|1,0,0]=2 325 B8R1.5 NC1=C(N=CC=C1)S Z411993618 [0,1,0,0,0,0|1,0,0]=2 326 B8R1.5 NC1=C(N=CC=N1)N Z1198174211 [0,1,0,0,0,0|2,0,0]=3 327 B8R1.5 NC1=C(N=CC=N1)S Z1203579756 [0,1,0,0,0,0|2,0,0]=3 328 B8R1.5 NC1=C(N=CN=C1)N Z316094270 [0,1,0,0,0,0|2,0,0]=3 329 B8R1.5 NC1=CC=NNC1=O Z3034935799 [0,1,0,0,0,0|2,0,0]=3 330 B8R1.5 NC1=CNC=NC1=O Z2213893347 [0,1,0,0,0,0|2,0,0]=3 331 B8R1.5 NC1=NC=CNC1=O Z3225902419 [0,1,0,0,0,0|2,0,0]=3 332 B8R1.5 NC1=[N+](C=CC=C1)N Z56872234 [0,1,0,0,0,0|3,0,0]=4 333 B8R1.5 O=C1C=CC=CN1O Z1198152560 [0,1,0,0,0,0|3,0,0]=4 334 B8R1.5 O=C1C=COC=C1O Z1198235068 [0,1,0,0,0,0|2,0,0]=3 335 B8R1.5 O=C1COC=CC1=S Z1513610972 [0,1,0,0,0,0|2,0,1]=4 336 B8R1.5 O=C1NC=CC=C1I Z1269208652 [0,1,0,0,0,0|1,0,1]=3 337 B8R1.5 O=C1NC=CC=C1O Z104495360 [0,1,0,0,0,0|1,0,1]=3 338 B8R1.5 O=C1NC=NC=C1Br Z1416282441 [0,1,0,0,0,0|2,0,0]=3 339 B8R1.5 O=C1NC=NC=C1F Z2235386850 [0,1,0,0,0,0|2,0,0]=3 340 B8R1.5 O=C1OC=CC=C1O Z1198156687 [0,1,0,0,0,0|2,0,0]=3 341 B8R1.5 OC1=C(C=CC=C1)Br Z56347198 [0,1,0,0,0,0|2,0,0]=3 342 B8R1.5 OC1=C(C=CC=C1)Cl Z104473270 [0,1,0,0,0,0|2,0,0]=3 343 B8R1.5 OC1=C(C=CC=C1)I Z384970702 [0,1,0,0,0,0|2,0,0]=3 344 B8R1.5 OC1=C(C=CC=C1)O Z104473810 [0,1,0,0,0,0|2,0,0]=3 345 B8R1.5 OC1=C(C=CC=N1)F Z850327726 [0,1,0,0,0,0|1,0,0]=2 346 B8R1.5 OC1=C(C=NC=N1)Cl Z1198222685 [0,1,0,0,0,0|2,0,0]=3 347 B8R1.5 OC1=C(N=CC=C1)F Z1198164106 [0,1,0,0,0,0|1,0,0]=2 348 B8R1.5 SC1=C(C=CC=N1)Br Z808603100 [0,1,0,0,0,0|1,0,0]=2 349 B8R1.5 SC1=C(C=CC=N1)Cl Z220567008 [0,1,0,0,0,0|1,0,0]=2 350 B8R1.5 [O-][N+]1=C(C=CC=C1)[S-] Z90667629 [0,1,0,0,0,0|3,0,0]=4 351 B6R0.4 C=CCCC(=O)C Z406376894 [0,0,1,0,0,0|2,0,1]=4 352 B6R0.4 C=CCNC(=O)C Z32064466 [0,0,1,0,0,0|3,0,0]=4 353 B6R1.2 BrC1=CNC=N1 Z1213725191 [0,0,0,0,1,0|2,0,0]=3 354 B6R1.2 CC1=CC=CN1 Z594218440 [0,0,0,0,1,0|0,0,1]=2 355 B6R1.2 CC1=CC=CO1 Z104472456 [0,0,0,0,1,0|1,0,0]=2 356 B6R1.2 CC1=CCNC1 Z1203734447 [0,0,0,0,1,0|0,0,3]=4 357 B6R1.2 CC1=CN=CN1 Z1945707502 [0,0,0,0,1,0|1,0,0]=2 358 B6R1.2 CC1=CN=CO1 Z1198180653 [0,0,0,0,1,0|1,0,0]=2 359 B6R1.2 CC1=CNC=C1 Z1203730789 [0,0,0,0,1,0|0,0,1]=2 360 B6R1.2 CC1=CNN=C1 Z600419582 [0,0,0,0,1,0|1,0,0]=2 361 B6R1.2 CC1=CNN=N1 Z1255358215 [0,0,0,0,1,0|2,0,0]=3 362 B6R1.2 CC1=COC=N1 Z1198313432 [0,0,0,0,1,0|1,0,0]=2 363 B6R1.2 CC1=NC=CN1 Z104494990 [0,0,0,0,1,0|1,0,0]=2 364 B6R1.2 CC1=NCCN1 Z204020260 [0,0,0,0,1,0|1,0,2]=4 365 B6R1.2 CC1=NCCS1 Z104480256 [0,0,0,0,1,0|1,0,2]=4 366 B6R1.2 CC1=NNC=C1 Z450469310 [0,0,0,0,1,0|1,0,0]=2 367 B6R1.2 CC1=NNC=N1 Z939944658 [0,0,0,0,1,0|2,0,0]=3 368 B6R1.2 CN1C=CC=C1 Z57127895 [0,0,0,0,1,0|1,0,0]=2 369 B6R1.2 CN1C=CC=N1 Z336081430 [0,0,0,0,1,0|1,0,0]=2 370 B6R1.2 CN1C=CN=C1 Z104506032 [0,0,0,0,1,0|1,0,0]=2 371 B6R1.2 CN1C=CN=N1 Z1198221873 [0,0,0,0,1,0|2,0,0]=3 372 B6R1.2 CN1C=NC=N1 Z237493308 [0,0,0,0,1,0|2,0,0]=3 373 B6R1.2 CN1C=NN=C1 Z2216303087 [0,0,0,0,1,0|2,0,0]=3 374 B6R1.2 CN1C=NN=N1 Z1198150919 [0,0,0,0,1,0|3,0,0]=4 375 B6R1.2 ClC1=CNN=C1 Z275169786 [0,0,0,0,1,0|2,0,0]=3 376 B6R1.2 ClC1=NC=NN1 Z56788868 [0,0,0,0,1,0|3,0,0]=4 377 B6R1.2 ClC1=NNC=C1 Z1255493581 [0,0,0,0,1,0|2,0,0]=3 378 B6R1.2 IC1=CNN=C1 Z1203162050 [0,0,0,0,1,0|2,0,0]=3 379 B6R1.2 NC1=CC=NO1 Z415654518 [0,0,0,0,1,0|2,0,0]=3 380 B6R1.2 NC1=CC=NS1 Z2568737642 [0,0,0,0,1,0|2,0,0]=3 381 B6R1.2 NC1=CN=NS1 Z1116303505 [0,0,0,0,1,0|3,0,0]=4 382 B6R1.2 NC1=CNC=N1 Z3241270014 [0,0,0,0,1,0|2,0,0]=3 383 B6R1.2 NC1=CNN=N1 Z1964347651 [0,0,0,0,1,0|3,0,0]=4 384 B6R1.2 NC1=CSC=C1 Z1962138158 [0,0,0,0,1,0|2,0,0]=3 385 B6R1.2 NC1=CSN=C1 Z2467685283 [0,0,0,0,1,0|2,0,0]=3 386 B6R1.2 NC1=CSN=N1 Z1868316819 [0,0,0,0,1,0|3,0,0]=4 387 B6R1.2 NC1=NC=CN1 Z1262237195 [0,0,0,0,1,0|2,0,0]=3 388 B6R1.2 NC1=NC=CO1 Z939904646 [0,0,0,0,1,0|2,0,0]=3 389 B6R1.2 NC1=NC=CS1 Z104472798 [0,0,0,0,1,0|2,0,0]=3 390 B6R1.2 NC1=NC=NS1 Z1827897976 [0,0,0,0,1,0|3,0,0]=4 391 B6R1.2 NC1=NN=CN1 Z56866006 [0,0,0,0,1,0|3,0,0]=4 392 B6R1.2 NC1=NN=CO1 Z277559304 [0,0,0,0,1,0|3,0,0]=4 393 B6R1.2 NC1=NN=CS1 Z56899142 [0,0,0,0,1,0|3,0,0]=4 394 B6R1.2 NC1=NNC=C1 Z240126818 [0,0,0,0,1,0|2,0,0]=3 395 B6R1.2 NC1=NON=C1 Z1203638167 [0,0,0,0,1,0|3,0,0]=4 396 B6R1.2 NC1=NSN=C1 Z2065788230 [0,0,0,0,1,0|3,0,0]=4 397 B6R1.2 O=C1C=CCO1 Z1219048777 [0,0,0,0,1,0|2,0,1]=4 398 B6R1.2 O=C1C=CNN1 Z1198154338 [0,0,0,0,1,0|2,0,1]=4 399 B6R1.2 O=C1C=CSN1 Z1741980421 [0,0,0,0,1,0|2,0,1]=4 400 B6R1.2 O=C1NC=CN1 Z1198148260 [0,0,0,0,1,0|2,0,1]=4 401 B6R1.2 O=C1NC=CS1 Z445210514 [0,0,0,0,1,0|2,0,1]=4 402 B6R1.2 OC1=NN=CS1 Z1238571564 [0,0,0,0,1,0|3,0,0]=4 403 B6R1.2 OC1=NOC=C1 Z1255501207 [0,0,0,0,1,0|2,0,0]=3 404 B6R1.2 OC1=NSN=C1 Z119989398 [0,0,0,0,1,0|3,0,0]=4 405 B6R1.2 ON1C=CC=N1 Z1198342489 [0,0,0,0,1,0|2,0,0]=3 406 B6R1.2 SC1=NC=CN1 Z1198723329 [0,0,0,0,1,0|2,0,0]=3 407 B6R1.2 SC1=NC=NN1 Z56871783 [0,0,0,0,1,0|3,0,0]=4 408 B6R1.2 SC1=NN=CS1 Z104503476 [0,0,0,0,1,0|3,0,0]=4 409 B6R1.2 [S-]C1=CN=NS1 Z1198153122 [0,0,0,0,1,0|3,0,0]=4 410 B5R0.2 C=C/C=C/CN Z3270208113 [1,0,1,0,0,0|0,0,2]=4 411 B7R1.1 C#CC1=NC=CS1 Z1255400696 [0,1,0,0,1,0|1,0,1]=4 412 B7R1.1 C#CC1=NNC=C1 Z1868316810 [0,1,0,0,1,0|1,0,1]=4 413 B7R1.1 CCC1=CC=CO1 Z640169748 [0,1,0,0,1,0|1,0,0]=3 414 B7R1.1 CCC1=CNC=N1 Z1203731354 [0,1,0,0,1,0|1,0,0]=3 415 B7R1.1 CCC1=CNN=C1 Z1139192482 [0,1,0,0,1,0|1,0,0]=3 416 B7R1.1 CCC1=NC=CN1 Z803154382 [0,1,0,0,1,0|1,0,0]=3 417 B7R1.1 CCC1=NN=CN1 Z2065464313 [0,1,0,0,1,0|2,0,0]=4 418 B7R1.1 CCC1=NNC=C1 Z1238571110 [0,1,0,0,1,0|1,0,0]=3 419 B7R1.1 CCN1C=CC=N1 Z600618624 [0,1,0,0,1,0|1,0,0]=3 420 B7R1.1 CCN1C=CN=C1 Z286789018 [0,1,0,0,1,0|1,0,0]=3 421 B7R1.1 CCN1C=CN=N1 Z4497103939 [0,1,0,0,1,0|2,0,0]=4 422 B7R1.1 CNC1=CNN=C1 Z1313483441 [0,1,0,0,1,0|1,0,0]=3 423 B7R1.1 CNC1=CNN=N1 Z5069198351 [0,1,0,0,1,0|2,0,0]=4 424 B7R1.1 CNC1=NC=CS1 Z336483296 [0,1,0,0,1,0|1,0,0]=3 425 B7R1.1 CNC1=NN=CO1 Z235540568 [0,1,0,0,1,0|2,0,0]=4 426 B7R1.1 CNC1=NN=CS1 Z1082870996 [0,1,0,0,1,0|2,0,0]=4 427 B7R1.1 CNC1=NOC=C1 Z2489381644 [0,1,0,0,1,0|1,0,0]=3 428 B7R1.1 COC1=CNN=C1 Z2525138345 [0,1,0,0,1,0|1,0,0]=3 429 B7R1.1 COC1=NN=CS1 Z1642058386 [0,1,0,0,1,0|2,0,0]=4 430 B7R1.1 COC1=NNC=C1 Z2130657375 [0,1,0,0,1,0|1,0,0]=3 431 B7R1.1 COC1=NSC=C1 Z1198333966 [0,1,0,0,1,0|1,0,0]=3 432 B7R1.1 CSC1=NC=CN1 Z1203730949 [0,1,0,0,1,0|1,0,0]=3 433 B7R1.1 N#CC1=CC=CS1 Z56946090 [0,1,0,0,1,0|1,0,1]=4 434 B7R1.1 N#CC1=CC=NN1 Z1082448654 [0,1,0,0,1,0|1,0,1]=4 435 B7R1.1 N#CC1=CN=CS1 Z1160900223 [0,1,0,0,1,0|1,0,1]=4 436 B7R1.1 N#CC1=CNC=C1 Z1198155834 [0,1,0,0,1,0|0,0,2]=4 437 B7R1.1 N#CC1=CNN=C1 Z1082448648 [0,1,0,0,1,0|1,0,1]=4 438 B7R1.1 N#CC1=COC=C1 Z1079178908 [0,1,0,0,1,0|1,0,1]=4 439 B7R1.1 N#CC1=COC=N1 Z1143441220 [0,1,0,0,1,0|1,0,1]=4 440 B7R1.1 N#CC1=CSC=C1 Z57900046 [0,1,0,0,1,0|1,0,1]=4 441 B7R1.1 N#CC1=CSC=N1 Z1079456078 [0,1,0,0,1,0|1,0,1]=4 442 B7R1.1 N#CC1=CSN=C1 Z1216812452 [0,1,0,0,1,0|1,0,1]=4 443 B7R1.1 N#CC1=NC=CN1 Z1198180312 [0,1,0,0,1,0|1,0,1]=4 444 B7R1.1 N#CC1=NC=CS1 Z1198221374 [0,1,0,0,1,0|1,0,1]=4 445 B7R1.1 N#CC1=NSC=C1 Z1255498705 [0,1,0,0,1,0|1,0,1]=4 446 B7R1.1 N#CN1C=CN=C1 Z1255365116 [0,1,0,0,1,0|1,0,1]=4 447 B7R1.1 NCC1=CC=CN1 Z976631692 [0,1,0,0,1,0|0,0,1]=3 448 B7R1.1 NCC1=CC=CS1 Z104485908 [0,1,0,0,1,0|1,0,0]=3 449 B7R1.1 NCC1=CC=NO1 Z1964347782 [0,1,0,0,1,0|1,0,0]=3 450 B7R1.1 NCC1=CC=NS1 Z2310716170 [0,1,0,0,1,0|1,0,0]=3 451 B7R1.1 NCC1=CN=CN1 Z1250100778 [0,1,0,0,1,0|1,0,0]=3 452 B7R1.1 NCC1=CNC=C1 Z1203586194 [0,1,0,0,1,0|0,0,1]=3 453 B7R1.1 NCC1=CNN=C1 Z1198394221 [0,1,0,0,1,0|1,0,0]=3 454 B7R1.1 NCC1=CNN=N1 Z2768172060 [0,1,0,0,1,0|2,0,0]=4 455 B7R1.1 NCC1=COC=C1 Z406680098 [0,1,0,0,1,0|1,0,0]=3 456 B7R1.1 NCC1=CSN=C1 Z2310727787 [0,1,0,0,1,0|1,0,0]=3 457 B7R1.1 NCC1=NC=CN1 Z1962341939 [0,1,0,0,1,0|1,0,0]=3 458 B7R1.1 NCC1=NC=CO1 Z4774639311 [0,1,0,0,1,0|1,0,0]=3 459 B7R1.1 NCC1=NC=CS1 Z1198107502 [0,1,0,0,1,0|1,0,0]=3 460 B7R1.1 NCC1=NC=NO1 Z2310727797 [0,1,0,0,1,0|2,0,0]=4 461 B7R1.1 NCC1=NN=CO1 Z104505014 [0,1,0,0,1,0|2,0,0]=4 462 B7R1.1 NCC1=NN=CS1 Z2738360224 [0,1,0,0,1,0|2,0,0]=4 463 B7R1.1 NCC1=NOC=C1 Z802903300 [0,1,0,0,1,0|1,0,0]=3 464 B7R1.1 NCC1=NOC=N1 Z1266854926 [0,1,0,0,1,0|2,0,0]=4 465 B7R1.1 NCC1=NON=C1 Z2944173400 [0,1,0,0,1,0|2,0,0]=4 466 B7R1.1 O=CC1=CC=CN1 Z104478580 [0,1,0,0,1,0|0,0,2]=4 467 B7R1.1 O=CC1=CC=CO1 Z57161925 [0,1,0,0,1,0|1,0,1]=4 468 B7R1.1 O=CC1=CC=CS1 Z104472120 [0,1,0,0,1,0|1,0,1]=4 469 B7R1.1 O=CC1=CNC=C1 Z1154253206 [0,1,0,0,1,0|0,0,2]=4 470 B7R1.1 O=CC1=CNN=C1 Z275127960 [0,1,0,0,1,0|1,0,1]=4 471 B7R1.1 O=CC1=COC=C1 Z1065630348 [0,1,0,0,1,0|1,0,1]=4 472 B7R1.1 O=CC1=COC=N1 Z1255431640 [0,1,0,0,1,0|1,0,1]=4 473 B7R1.1 O=CC1=CSC=C1 Z57887873 [0,1,0,0,1,0|1,0,1]=4 474 B7R1.1 O=CC1=CSC=N1 Z734052598 [0,1,0,0,1,0|1,0,1]=4 475 B7R1.1 O=CC1=NNC=C1 Z234896951 [0,1,0,0,1,0|1,0,1]=4 476 B7R1.1 OCC1=CC=CO1 Z104472794 [0,1,0,0,1,0|1,0,0]=3 477 B7R1.1 OCC1=CC=CS1 Z104478586 [0,1,0,0,1,0|1,0,0]=3 478 B7R1.1 OCC1=CNC=N1 Z234898057 [0,1,0,0,1,0|1,0,0]=3 479 B7R1.1 OCC1=CNN=C1 Z812520032 [0,1,0,0,1,0|1,0,0]=3 480 B7R1.1 OCC1=COC=C1 Z397587426 [0,1,0,0,1,0|1,0,0]=3 481 B7R1.1 OCC1=CSN=N1 Z234897281 [0,1,0,0,1,0|2,0,0]=4 482 B7R1.1 OCC1=NC=CN1 Z825761068 [0,1,0,0,1,0|1,0,0]=3 483 B7R1.1 OCC1=NC=CS1 Z57161013 [0,1,0,0,1,0|1,0,0]=3 484 B7R1.1 OCC1=NN=CN1 Z2574360328 [0,1,0,0,1,0|2,0,0]=4 485 B7R1.1 OCC1=NOC=C1 Z875021162 [0,1,0,0,1,0|1,0,0]=3 486 B7R1.1 OCN1C=CC=N1 Z1198155714 [0,1,0,0,1,0|1,0,0]=3 487 B7R1.1 OCN1C=NC=N1 Z57071658 [0,1,0,0,1,0|2,0,0]=4 488 B7R1.2 BrC1=CN=C(S1)Br Z1267861077 [0,1,0,0,1,0|2,0,0]=4 489 B7R1.2 BrC1=CSC(=C1)Br Z1245646694 [0,1,0,0,1,0|2,0,0]=4 490 B7R1.2 BrC1=CSC(=N1)Br Z600503298 [0,1,0,0,1,0|2,0,0]=4 491 B7R1.2 CC1=CC(=NN1)C Z50145988 [0,1,0,0,1,0|1,0,0]=3 492 B7R1.2 CC1=CC(=NO1)N Z104503828 [0,1,0,0,1,0|1,0,0]=3 493 B7R1.2 CC1=CC(=NS1)N Z1198165856 [0,1,0,0,1,0|1,0,0]=3 494 B7R1.2 CC1=CC(=O)NO1 Z56761467 [0,1,0,0,1,0|1,0,1]=4 495 B7R1.2 CC1=CC=C(S1)Br Z1255383262 [0,1,0,0,1,0|1,0,0]=3 496 B7R1.2 CC1=CN=C(N1)O Z2630875693 [0,1,0,0,1,0|1,0,0]=3 497 B7R1.2 CC1=CN=C(O1)N Z994267654 [0,1,0,0,1,0|1,0,0]=3 498 B7R1.2 CC1=CN=C(S1)N Z104500072 [0,1,0,0,1,0|1,0,0]=3 499 B7R1.2 CC1=CNC(=N1)C Z217301646 [0,1,0,0,1,0|1,0,0]=3 500 B7R1.2 CC1=CNC(=N1)N Z2515238565 [0,1,0,0,1,0|1,0,0]=3 501 B7R1.2 CC1=CNC(=N1)S Z1198163268 [0,1,0,0,1,0|1,0,0]=3 502 B7R1.2 CC1=COC(=N1)S Z1416179155 [0,1,0,0,1,0|1,0,0]=3 503 B7R1.2 CC1=CSC(=N1)N Z48847548 [0,1,0,0,1,0|1,0,0]=3 504 B7R1.2 CC1=CSC(=N1)S Z203045926 [0,1,0,0,1,0|1,0,0]=3 505 B7R1.2 CC1=CSC(=O)N1 Z57055803 [0,1,0,0,1,0|1,0,1]=4 506 B7R1.2 CC1=NC(=NO1)N Z1147462977 [0,1,0,0,1,0|2,0,0]=4 507 B7R1.2 CC1=NC(=NS1)N Z1198313987 [0,1,0,0,1,0|2,0,0]=4 508 B7R1.2 CC1=NC(=O)NN1 Z2234631231 [0,1,0,0,1,0|2,0,0]=4 509 B7R1.2 CC1=NC=C(S1)N Z951517342 [0,1,0,0,1,0|1,0,0]=3 510 B7R1.2 CC1=NN=C(N1)N Z951367902 [0,1,0,0,1,0|2,0,0]=4 511 B7R1.2 CC1=NN=C(O1)N Z56957510 [0,1,0,0,1,0|2,0,0]=4 512 B7R1.2 CC1=NN=C(O1)S Z55879328 [0,1,0,0,1,0|2,0,0]=4 513 B7R1.2 CC1=NN=C(S1)Br Z431956576 [0,1,0,0,1,0|2,0,0]=4 514 B7R1.2 CC1=NN=C(S1)N Z56900928 [0,1,0,0,1,0|2,0,0]=4 515 B7R1.2 CC1=NN=C(S1)O Z1238571569 [0,1,0,0,1,0|2,0,0]=4 516 B7R1.2 CC1=NN=C(S1)S Z104485716 [0,1,0,0,1,0|2,0,0]=4 517 B7R1.2 CC1=NNC(=C1)N Z55423088 [0,1,0,0,1,0|1,0,0]=3 518 B7R1.2 CC1=NNC(=N1)C Z57161895 [0,1,0,0,1,0|2,0,0]=4 519 B7R1.2 CC1=NNC(=N1)S Z55982146 [0,1,0,0,1,0|2,0,0]=4 520 B7R1.2 CC1=NNC(=O)C1 Z50145989 [0,1,0,0,1,0|1,0,1]=4 521 B7R1.2 CC1=NNC(=O)O1 Z1198174319 [0,1,0,0,1,0|2,0,0]=4 522 B7R1.2 CC1=NOC(=C1)N Z118429566 [0,1,0,0,1,0|1,0,0]=3 523 B7R1.2 CC1=NOC(=N1)N Z339356524 [0,1,0,0,1,0|2,0,0]=4 524 B7R1.2 CC1=NOC(=N1)O Z1258992446 [0,1,0,0,1,0|2,0,0]=4 525 B7R1.2 CC1=NOC(=N1)S Z1033258624 [0,1,0,0,1,0|2,0,0]=4 526 B7R1.2 CC1=NSC(=C1)N Z204042038 [0,1,0,0,1,0|1,0,0]=3 527 B7R1.2 CC1=NSC(=N1)Cl Z368555490 [0,1,0,0,1,0|2,0,0]=4 528 B7R1.2 CC1=NSC(=N1)N Z431702718 [0,1,0,0,1,0|2,0,0]=4 529 B7R1.2 CN1C=C(C=N1)Br Z337709426 [0,1,0,0,1,0|1,0,0]=3 530 B7R1.2 CN1C=C(C=N1)I Z957334240 [0,1,0,0,1,0|1,0,0]=3 531 B7R1.2 CN1C=C(C=N1)N Z1741968059 [0,1,0,0,1,0|1,0,0]=3 532 B7R1.2 CN1C=C(C=N1)O Z1258763763 [0,1,0,0,1,0|1,0,0]=3 533 B7R1.2 CN1C=C(N=N1)Br Z1198276396 [0,1,0,0,1,0|2,0,0]=4 534 B7R1.2 CN1C=C(N=N1)N Z2177030666 [0,1,0,0,1,0|2,0,0]=4 535 B7R1.2 CN1C=CC(=N1)O Z1343577415 [0,1,0,0,1,0|1,0,0]=3 536 B7R1.2 CN1C=NC(=C1)N Z2472857442 [0,1,0,0,1,0|1,0,0]=3 537 B7R1.2 CN1C=NC(=N1)N Z57466217 [0,1,0,0,1,0|2,0,0]=4 538 B7R1.2 CN1C=NC(=O)N1 Z1777885320 [0,1,0,0,1,0|2,0,0]=4 539 B7R1.2 ClC1=CC=C(S1)Br Z1203161749 [0,1,0,0,1,0|2,0,0]=4 540 B7R1.2 NC1=CSC(=N1)N Z190661742 [0,1,0,0,1,0|2,0,0]=4 541 B7R1.2 NC1=CSC(=N1)O Z1033300716 [0,1,0,0,1,0|2,0,0]=4 542 B7R1.2 NC1=NC=C(S1)Br Z57032577 [0,1,0,0,1,0|2,0,0]=4 543 B7R1.2 NC1=NC=C(S1)F Z1198184822 [0,1,0,0,1,0|2,0,0]=4 544 B7R1.2 O=C1C=CC(=O)C1 Z1083219844 [0,1,0,0,1,0|1,0,1]=4 545 B7R1.2 O=C1C=CC(=O)N1 Z223655288 [0,1,0,0,1,0|1,0,1]=4 546 B7R1.4 CC1=C(C=CS1)Br Z1201624904 [0,1,0,0,1,0|1,0,0]=3 547 B7R1.4 CC1=C(C=NN1)Cl Z1507502582 [0,1,0,0,1,0|1,0,0]=3 548 B7R1.4 CC1=C(C=NO1)I Z1269175158 [0,1,0,0,1,0|1,0,0]=3 549 B7R1.4 CC1=C(C=NO1)N Z1465461252 [0,1,0,0,1,0|1,0,0]=3 550 B7R1.4 CC1=C(NN=N1)N Z2527856121 [0,1,0,0,1,0|2,0,0]=4 551 B7R1.4 CC1=C(ON=C1)N Z815305382 [0,1,0,0,1,0|1,0,0]=3 552 B7R1.4 CC1=C(SC=N1)N Z1815155510 [0,1,0,0,1,0|1,0,0]=3 553 B7R1.4 CC1=C(SN=C1)N Z3716437679 [0,1,0,0,1,0|1,0,0]=3 554 B7R1.4 CC1=CC=NN1C Z826535916 [0,1,0,0,1,0|1,0,0]=3 555 B7R1.4 CC1=CNC=C1C Z1198162792 [0,1,0,0,1,0|0,0,1]=3 556 B7R1.4 CC1=CON=C1N Z995041844 [0,1,0,0,1,0|1,0,0]=3 557 B7R1.4 CC1=CSC=C1N Z1492796718 [0,1,0,0,1,0|1,0,0]=3 558 B7R1.4 CC1=NN=CN1C Z422646574 [0,1,0,0,1,0|2,0,0]=4 559 B7R1.4 CC1=NNC=C1N Z600615694 [0,1,0,0,1,0|1,0,0]=3 560 B7R1.4 CC1=NOC=C1N Z2466617876 [0,1,0,0,1,0|1,0,0]=3 561 B7R1.4 CC1=NON=C1N Z57948408 [0,1,0,0,1,0|2,0,0]=4 562 B7R1.4 CC1=NSC=C1N Z2737427927 [0,1,0,0,1,0|1,0,0]=3 563 B7R1.4 CN1C=CN=C1Br Z959380970 [0,1,0,0,1,0|1,0,0]=3 564 B7R1.4 CN1C=CN=C1N Z2309759326 [0,1,0,0,1,0|1,0,0]=3 565 B7R1.4 CN1C=CN=C1S Z57901905 [0,1,0,0,1,0|1,0,0]=3 566 B7R1.4 CN1C=CNC1=O Z1198329852 [0,1,0,0,1,0|1,0,1]=4 567 B7R1.4 CN1C=COC1=O Z2732441923 [0,1,0,0,1,0|2,0,0]=4 568 B7R1.4 CN1C=NC=C1Cl Z168874650 [0,1,0,0,1,0|1,0,0]=3 569 B7R1.4 CN1C=NN=C1N Z1692788308 [0,1,0,0,1,0|2,0,0]=4 570 B7R1.4 CN1C=NN=C1S Z56922095 [0,1,0,0,1,0|2,0,0]=4 571 B7R1.4 CN1C=NNC1=O Z1526503443 [0,1,0,0,1,0|2,0,0]=4 572 B7R1.4 CN1N=CC=C1N Z415654476 [0,1,0,0,1,0|1,0,0]=3 573 B7R1.4 CN1N=CN=C1N Z56757681 [0,1,0,0,1,0|2,0,0]=4 574 B7R1.4 CN1N=CN=C1S Z1655141058 [0,1,0,0,1,0|2,0,0]=4 575 B7R1.4 CN1N=NC=C1N Z4351247746 [0,1,0,0,1,0|2,0,0]=4 576 B7R1.4 CN1N=NC=C1O Z4561746935 [0,1,0,0,1,0|2,0,0]=4 577 B7R1.4 CN1NC=NC1=O Z1582263737 [0,1,0,0,1,0|2,0,0]=4 578 B7R1.4 CN1SC=CC1=O Z3227502095 [0,1,0,0,1,0|2,0,0]=4 579 B7R1.4 C[N+]1=C(SC=C1)N Z56872230 [0,1,0,0,1,0|2,0,0]=4 580 B7R1.4 ClC1=CSC=C1Cl Z1198181374 [0,1,0,0,1,0|2,0,0]=4 581 B7R1.4 NC1=C(C=NN1)F Z3489104737 [0,1,0,0,1,0|2,0,0]=4 582 B7R1.4 NC1=CNN=C1N Z802599594 [0,1,0,0,1,0|2,0,0]=4 583 B7R1.4 NC1=CSC=C1Br Z2235409323 [0,1,0,0,1,0|2,0,0]=4 584 B7R1.4 NC1=NNC=C1Cl Z1741966355 [0,1,0,0,1,0|2,0,0]=4 585 B7R1.4 NC1=NNC=C1I Z1269216483 [0,1,0,0,1,0|2,0,0]=4 586 B7R1.4 OC1=NSC=C1Br Z3243456041 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.5 NC1=CC=CC=CC1=O Z1203578079 [0,1,0,0,0,1|2,0,0]=4 588 B9R1.5 O=C1C=CC=CC=C1O Z2895182175 [0,1,0,0,0,1|2,0,0]=4 589 B9R1.1 BrCC1=NC=C(N=C1)Br Z3244822385 [0,2,0,0,0,0|1,0,0]=3 590 B9R1.1 C#CC1=CN=C(C=N1)Cl Z1255362190 [0,2,0,0,0,0|1,0,1]=4 591 B9R1.1 C#CC1=CN=C(N=C1)Br Z1626920986 [0,2,0,0,0,0|1,0,1]=4 592 B9R1.1 C#CC1=CN=C(N=C1)Cl Z1255388510 [0,2,0,0,0,0|1,0,1]=4 593 B9R1.1 C#CC1=CN=C(N=C1)N Z1203580093 [0,2,0,0,0,0|1,0,1]=4 594 B9R1.1 C#CC1=NN=C(C=C1)Cl Z1813100731 [0,2,0,0,0,0|1,0,1]=4 595 B9R1.1 C=CC1=CN=C(C=C1)Cl Z4879401150 [0,2,0,0,0,0|0,0,1]=3 596 B9R1.1 C=CC1=CN=C(C=C1)F Z1255363901 [0,2,0,0,0,0|0,0,1]=3 597 B9R1.1 C=CC1=NC=C(C=C1)C Z1198181628 [0,2,0,0,0,0|0,0,0]=2 598 B9R1.1 CC1=CC=C(C=C1)C#N Z56965882 [0,2,0,0,0,0|1,0,0]=3 599 B9R1.1 CC1=CC=C(C=C1)C=O Z104477698 [0,2,0,0,0,0|1,0,0]=3 600 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [0,2,0,0,0,0|1,0,0]=3 601 B9R1.1 CC1=CN=C(C=C1)C=O Z1198172069 [0,2,0,0,0,0|0,0,0]=2 602 B9R1.1 CC1=CN=C(C=C1)CO Z1198270889 [0,2,0,0,0,0|0,0,0]=2 603 B9R1.1 CC1=CN=C(N=C1)C#N Z1255367306 [0,2,0,0,0,0|1,0,0]=3 604 B9R1.1 CC1=CN=C(N=C1)CN Z2327893645 [0,2,0,0,0,0|1,0,0]=3 605 B9R1.1 CC1=CN=C(N=C1)CO Z1198277216 [0,2,0,0,0,0|1,0,0]=3 606 B9R1.1 CC1=NC=C(C=C1)C#N Z362778572 [0,2,0,0,0,0|0,0,1]=3 607 B9R1.1 CC1=NC=C(C=C1)C=O Z744849420 [0,2,0,0,0,0|0,0,1]=3 608 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [0,2,0,0,0,0|0,0,0]=2 609 B9R1.1 CC1=NC=C(C=C1)CO Z397587474 [0,2,0,0,0,0|0,0,0]=2 610 B9R1.1 CC1=NC=C(C=N1)C=O Z274575088 [0,2,0,0,0,0|1,0,1]=4 611 B9R1.1 CC1=NC=C(C=N1)CO Z1013716404 [0,2,0,0,0,0|1,0,0]=3 612 B9R1.1 CC1=NC=C(N=C1)C#N Z1198164470 [0,2,0,0,0,0|1,0,0]=3 613 B9R1.1 CC1=NC=C(N=C1)C=O Z1079442402 [0,2,0,0,0,0|1,0,0]=3 614 B9R1.1 CC1=NC=C(N=C1)CN Z3271770568 [0,2,0,0,0,0|1,0,0]=3 615 B9R1.1 CC1=NC=C(N=C1)CO Z397587476 [0,2,0,0,0,0|1,0,0]=3 616 B9R1.1 CC1=NN=C(C=C1)C#N Z1255388520 [0,2,0,0,0,0|1,0,0]=3 617 B9R1.1 CC1=NN=C(C=C1)C=O Z1198176701 [0,2,0,0,0,0|1,0,0]=3 618 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [0,2,0,0,0,0|1,0,0]=3 619 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [0,2,0,0,0,0|1,0,0]=3 620 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [0,2,0,0,0,0|1,0,0]=3 621 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [0,2,0,0,0,0|0,0,0]=2 622 B9R1.1 CCC1=CN=C(N=C1)Br Z1255367602 [0,2,0,0,0,0|1,0,0]=3 623 B9R1.1 CCC1=CN=C(N=C1)Cl Z1255423971 [0,2,0,0,0,0|1,0,0]=3 624 B9R1.1 CCC1=CN=C(N=C1)N Z1137168329 [0,2,0,0,0,0|1,0,0]=3 625 B9R1.1 CCC1=NC=C(C=N1)N Z381402598 [0,2,0,0,0,0|2,0,0]=4 626 B9R1.1 CCC1=NC=C(N=C1)Br Z1198319305 [0,2,0,0,0,0|1,0,0]=3 627 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [0,2,0,0,0,0|1,0,0]=3 628 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [0,2,0,0,0,0|1,0,0]=3 629 B9R1.1 CNC1=NC=C(C=C1)Br Z359297630 [0,2,0,0,0,0|1,0,0]=3 630 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [0,2,0,0,0,0|0,0,0]=2 631 B9R1.1 CNC1=NC=C(C=C1)Cl Z359297632 [0,2,0,0,0,0|1,0,0]=3 632 B9R1.1 CNC1=NC=C(C=C1)F Z802823886 [0,2,0,0,0,0|1,0,0]=3 633 B9R1.1 CNC1=NC=C(C=N1)Br Z801570098 [0,2,0,0,0,0|2,0,0]=4 634 B9R1.1 CNC1=NC=C(C=N1)F Z1203821135 [0,2,0,0,0,0|2,0,0]=4 635 B9R1.1 CNC1=NC=C(C=N1)I Z1342834460 [0,2,0,0,0,0|2,0,0]=4 636 B9R1.1 CNC1=NC=C(C=N1)N Z760033016 [0,2,0,0,0,0|2,0,0]=4 637 B9R1.1 CNC1=NN=C(C=C1)C Z802821708 [0,2,0,0,0,0|1,0,0]=3 638 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [0,2,0,0,0,0|1,0,0]=3 639 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [0,2,0,0,0,0|1,0,0]=3 640 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [0,2,0,0,0,0|1,0,0]=3 641 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [0,2,0,0,0,0|1,0,0]=3 642 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [0,2,0,0,0,0|0,0,0]=2 643 B9R1.1 COC1=CN=C(N=C1)N Z56767572 [0,2,0,0,0,0|1,0,0]=3 644 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [0,2,0,0,0,0|1,0,0]=3 645 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [0,2,0,0,0,0|1,0,0]=3 646 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [0,2,0,0,0,0|1,0,0]=3 647 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [0,2,0,0,0,0|1,0,0]=3 648 B9R1.1 COC1=NN=C(C=C1)N Z1201621262 [0,2,0,0,0,0|1,0,0]=3 649 B9R1.1 COC1=NNC(=O)C=C1 Z1255391084 [0,2,0,0,0,0|1,0,1]=4 650 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [0,2,0,0,0,0|1,0,0]=3 651 B9R1.1 CSC1=CN=C(C=C1)N Z412025068 [0,2,0,0,0,0|0,0,0]=2 652 B9R1.1 CSC1=NC=C(C=C1)N Z412022842 [0,2,0,0,0,0|1,0,0]=3 653 B9R1.1 CSC1=NC=C(C=N1)Br Z729560458 [0,2,0,0,0,0|2,0,0]=4 654 B9R1.1 CSC1=NC=C(C=N1)O Z1198152371 [0,2,0,0,0,0|2,0,0]=4 655 B9R1.1 CSC1=NN=C(C=C1)Br Z1269231852 [0,2,0,0,0,0|1,0,0]=3 656 B9R1.1 CSC1=NN=C(C=C1)Cl Z732207922 [0,2,0,0,0,0|1,0,0]=3 657 B9R1.1 CSC1=NN=C(C=N1)C Z1255500736 [0,2,0,0,0,0|2,0,0]=4 658 B9R1.1 CSC1=NNC(=O)C=C1 Z3300726140 [0,2,0,0,0,0|1,0,1]=4 659 B9R1.1 ClCC1=NC=C(N=C1)Cl Z1198277950 [0,2,0,0,0,0|1,0,0]=3 660 B9R1.1 ClCC1=NN=C(C=C1)Cl Z2738352569 [0,2,0,0,0,0|1,0,0]=3 661 B9R1.1 FC1=CC=C(C=C1)CBr Z89269613 [0,2,0,0,0,0|1,0,0]=3 662 B9R1.1 FCC1=CN=C(N=C1)Cl Z1278925496 [0,2,0,0,0,0|1,0,0]=3 663 B9R1.1 N#CC1=CC=C(C=C1)Br Z55928801 [0,2,0,0,0,0|1,0,1]=4 664 B9R1.1 N#CC1=CC=C(C=C1)Cl Z56942044 [0,2,0,0,0,0|1,0,1]=4 665 B9R1.1 N#CC1=CC=C(C=C1)I Z57899725 [0,2,0,0,0,0|1,0,1]=4 666 B9R1.1 N#CC1=CC=C(C=C1)N Z57073771 [0,2,0,0,0,0|1,0,1]=4 667 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [0,2,0,0,0,0|1,0,1]=4 668 B9R1.1 N#CC1=CN=C(C=C1)N Z295203362 [0,2,0,0,0,0|0,0,1]=3 669 B9R1.1 N#CC1=CN=C(C=C1)S Z271138138 [0,2,0,0,0,0|0,0,1]=3 670 B9R1.1 N#CC1=CN=C(C=N1)Cl Z1095350204 [0,2,0,0,0,0|1,0,1]=4 671 B9R1.1 N#CC1=CN=C(C=N1)F Z1681360151 [0,2,0,0,0,0|1,0,1]=4 672 B9R1.1 N#CC1=CNC(=O)C=C1 Z217164566 [0,2,0,0,0,0|0,0,2]=4 673 B9R1.1 N#CC1=NC=C(C=C1)Br Z1079179246 [0,2,0,0,0,0|1,0,0]=3 674 B9R1.1 N#CC1=NC=C(C=C1)N Z1065674734 [0,2,0,0,0,0|1,0,0]=3 675 B9R1.1 N#CC1=NC=C(C=N1)Br Z1201621894 [0,2,0,0,0,0|2,0,0]=4 676 B9R1.1 N#CC1=NC=C(C=N1)Cl Z1198161170 [0,2,0,0,0,0|2,0,0]=4 677 B9R1.1 N#CC1=NC=C(C=N1)O Z1255431911 [0,2,0,0,0,0|2,0,0]=4 678 B9R1.1 N#CC1=NN=C(C=C1)Br Z1255379965 [0,2,0,0,0,0|1,0,1]=4 679 B9R1.1 N#CC1=NN=C(C=C1)Cl Z1198233597 [0,2,0,0,0,0|1,0,1]=4 680 B9R1.1 N#CC1=NN=C(C=C1)I Z2327114962 [0,2,0,0,0,0|1,0,1]=4 681 B9R1.1 N#CC1=NNC(=O)C=C1 Z1551950054 [0,2,0,0,0,0|2,0,0]=4 682 B9R1.1 NC1=NC=C(C=C1)CO Z960446254 [0,2,0,0,0,0|0,0,0]=2 683 B9R1.1 NC1=NC=C(C=N1)C=O Z274575486 [0,2,0,0,0,0|1,0,1]=4 684 B9R1.1 NC1=NC=C(C=N1)CO Z1198267212 [0,2,0,0,0,0|1,0,0]=3 685 B9R1.1 NC1=NC=C(N=C1)CO Z1203583050 [0,2,0,0,0,0|1,0,0]=3 686 B9R1.1 NC1=NN=C(C=C1)CO Z2739402763 [0,2,0,0,0,0|1,0,0]=3 687 B9R1.1 NCC1=CC=C(C=C1)F Z54748266 [0,2,0,0,0,0|1,0,0]=3 688 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [0,2,0,0,0,0|1,0,0]=3 689 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [0,2,0,0,0,0|0,0,0]=2 690 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [0,2,0,0,0,0|0,0,0]=2 691 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [0,2,0,0,0,0|0,0,0]=2 692 B9R1.1 NCC1=CN=C(N=C1)Cl Z3244522008 [0,2,0,0,0,0|1,0,0]=3 693 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [0,2,0,0,0,0|1,0,0]=3 694 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [0,2,0,0,0,0|1,0,0]=3 695 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [0,2,0,0,0,0|1,0,0]=3 696 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [0,2,0,0,0,0|1,0,0]=3 697 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [0,2,0,0,0,0|1,0,0]=3 698 B9R1.1 NCC1=NC=C(C=N1)Br Z2901974002 [0,2,0,0,0,0|2,0,0]=4 699 B9R1.1 NCC1=NC=C(C=N1)Cl Z3243815124 [0,2,0,0,0,0|2,0,0]=4 700 B9R1.1 NCC1=NC=C(N=C1)Br Z1416181963 [0,2,0,0,0,0|1,0,0]=3 701 B9R1.1 NCC1=NC=C(N=C1)Cl Z1198278893 [0,2,0,0,0,0|1,0,0]=3 702 B9R1.1 NCC1=NN=C(C=C1)Cl Z3976570544 [0,2,0,0,0,0|1,0,0]=3 703 B9R1.1 NCC1=NNC(=O)C=C1 Z2230911335 [0,2,0,0,0,0|1,0,1]=4 704 B9R1.1 NNC1=CC=C(C=C1)Cl Z56776889 [0,2,0,0,0,0|2,0,0]=4 705 B9R1.1 NNC1=NN=C(C=C1)Cl Z56821805 [0,2,0,0,0,0|2,0,0]=4 706 B9R1.1 O=CC1=CC=C(C=C1)Br Z57162109 [0,2,0,0,0,0|1,0,1]=4 707 B9R1.1 O=CC1=CC=C(C=C1)Cl Z57772447 [0,2,0,0,0,0|1,0,1]=4 708 B9R1.1 O=CC1=CC=C(C=C1)F Z104472914 [0,2,0,0,0,0|1,0,1]=4 709 B9R1.1 O=CC1=CC=C(C=C1)I Z57887684 [0,2,0,0,0,0|1,0,1]=4 710 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [0,2,0,0,0,0|1,0,1]=4 711 B9R1.1 O=CC1=CC=C(C=C1)S Z1198150788 [0,2,0,0,0,0|1,0,1]=4 712 B9R1.1 O=CC1=CN=C(C=C1)O Z1741969170 [0,2,0,0,0,0|0,0,1]=3 713 B9R1.1 O=CC1=CN=C(N=C1)I Z1646079855 [0,2,0,0,0,0|1,0,1]=4 714 B9R1.1 O=CC1=NC=C(C=C1)Br Z1079442796 [0,2,0,0,0,0|1,0,0]=3 715 B9R1.1 O=CC1=NC=C(C=C1)Cl Z1198177123 [0,2,0,0,0,0|1,0,0]=3 716 B9R1.1 O=CC1=NC=C(C=C1)F Z1201624239 [0,2,0,0,0,0|1,0,0]=3 717 B9R1.1 O=CC1=NC=C(C=C1)O Z1741979912 [0,2,0,0,0,0|1,0,0]=3 718 B9R1.1 OCC1=CC=C(C=C1)Br Z335244742 [0,2,0,0,0,0|1,0,0]=3 719 B9R1.1 OCC1=CC=C(C=C1)Cl Z104478032 [0,2,0,0,0,0|1,0,0]=3 720 B9R1.1 OCC1=CC=C(C=C1)F Z104477460 [0,2,0,0,0,0|1,0,0]=3 721 B9R1.1 OCC1=CC=C(C=C1)I Z385370342 [0,2,0,0,0,0|1,0,0]=3 722 B9R1.1 OCC1=NC=C(C=C1)Br Z1065600752 [0,2,0,0,0,0|1,0,0]=3 723 B9R1.1 OCC1=NC=C(C=C1)Cl Z1198272591 [0,2,0,0,0,0|1,0,0]=3 724 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [0,2,0,0,0,0|1,0,0]=3 725 B9R1.1 OCC1=NC=C(C=N1)I Z4624804538 [0,2,0,0,0,0|2,0,0]=4 726 B9R1.1 OCC1=NC=C(N=C1)Br Z1255381074 [0,2,0,0,0,0|1,0,0]=3 727 B9R1.1 OCC1=NN=C(C=C1)Cl Z2418413578 [0,2,0,0,0,0|1,0,0]=3 728 B9R1.1 SCC1=CC=C(C=C1)Cl Z55948216 [0,2,0,0,0,0|1,0,0]=3 729 B9R1.2 C#CC1=CC=CC(=C1)Cl Z1080385596 [0,2,0,0,0,0|1,0,1]=4 730 B9R1.2 C#CC1=CC=CC(=C1)N Z235485474 [0,2,0,0,0,0|1,0,1]=4 731 B9R1.2 C#CC1=CC=CC(=N1)C Z1198181708 [0,2,0,0,0,0|2,0,0]=4 732 B9R1.2 C#CC1=CN=CC(=C1)Br Z1198278451 [0,2,0,0,0,0|0,0,1]=3 733 B9R1.2 C#CC1=CN=CC(=C1)Cl Z1198232594 [0,2,0,0,0,0|0,0,1]=3 734 B9R1.2 C#CC1=CN=CC(=C1)F Z1080385592 [0,2,0,0,0,0|0,0,1]=3 735 B9R1.2 CC1=CC(=CC=C1)C=O Z104478208 [0,2,0,0,0,0|1,0,0]=3 736 B9R1.2 CC1=CC(=CC=C1)NN Z56943685 [0,2,0,0,0,0|1,0,0]=3 737 B9R1.2 CC1=CC(=CN=C1)C#N Z1203162272 [0,2,0,0,0,0|0,0,0]=2 738 B9R1.2 CC1=CC(=CN=C1)C=O Z1198176743 [0,2,0,0,0,0|0,0,0]=2 739 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [0,2,0,0,0,0|0,0,0]=2 740 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [0,2,0,0,0,0|0,0,0]=2 741 B9R1.2 CC1=CC(=NC=C1)C#N Z1160863237 [0,2,0,0,0,0|2,0,0]=4 742 B9R1.2 CC1=CC(=NC=C1)C=O Z1201624018 [0,2,0,0,0,0|2,0,0]=4 743 B9R1.2 CC1=CC(=NN=C1)C#N Z1222424799 [0,2,0,0,0,0|1,0,0]=3 744 B9R1.2 CC1=NC(=CC=C1)C#N Z445153364 [0,2,0,0,0,0|2,0,0]=4 745 B9R1.2 CC1=NC(=CC=C1)C=O Z1079442396 [0,2,0,0,0,0|2,0,0]=4 746 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [0,2,0,0,0,0|2,0,0]=4 747 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [0,2,0,0,0,0|2,0,0]=4 748 B9R1.2 CC1=NC(=CN=C1)C#N Z1198181973 [0,2,0,0,0,0|1,0,0]=3 749 B9R1.2 CC1=NC=CC(=C1)C#N Z1198166362 [0,2,0,0,0,0|2,0,0]=4 750 B9R1.2 CC1=NC=CC(=C1)C=O Z1198168755 [0,2,0,0,0,0|2,0,0]=4 751 B9R1.2 CC1=NC=CC(=C1)CO Z1198175905 [0,2,0,0,0,0|2,0,0]=4 752 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [0,2,0,0,0,0|1,0,0]=3 753 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [0,2,0,0,0,0|1,0,0]=3 754 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [0,2,0,0,0,0|2,0,0]=4 755 B9R1.2 CC[N+]1=CC(=CC=C1)O Z2168499555 [0,2,0,0,0,0|1,0,1]=4 756 B9R1.2 CNC1=CC(=CC=C1)F Z335274194 [0,2,0,0,0,0|1,0,0]=3 757 B9R1.2 CNC1=CC(=CC=C1)I Z4085232023 [0,2,0,0,0,0|1,0,0]=3 758 B9R1.2 CNC1=CC(=CC=C1)N Z376447548 [0,2,0,0,0,0|1,0,0]=3 759 B9R1.2 CNC1=CC(=CC=C1)O Z1082872246 [0,2,0,0,0,0|1,0,0]=3 760 B9R1.2 CNC1=CC(=CN=C1)Br Z1255444030 [0,2,0,0,0,0|0,0,0]=2 761 B9R1.2 CNC1=CC(=NC=C1)C Z1203748481 [0,2,0,0,0,0|2,0,0]=4 762 B9R1.2 CNC1=CC(=O)NN=C1 Z1270443752 [0,2,0,0,0,0|1,0,0]=3 763 B9R1.2 CNC1=NC(=CC=C1)C Z600403388 [0,2,0,0,0,0|2,0,0]=4 764 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [0,2,0,0,0,0|1,0,0]=3 765 B9R1.2 COC1=CC(=CC=C1)N Z104472536 [0,2,0,0,0,0|1,0,0]=3 766 B9R1.2 COC1=CC(=CC=C1)O Z104478798 [0,2,0,0,0,0|1,0,0]=3 767 B9R1.2 COC1=CC(=NC=C1)N Z1201624123 [0,2,0,0,0,0|2,0,0]=4 768 B9R1.2 COC1=CC(=O)NC=C1 Z1741975851 [0,2,0,0,0,0|2,0,0]=4 769 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [0,2,0,0,0,0|2,0,0]=4 770 B9R1.2 COC1=NC(=CN=C1)N Z1198261569 [0,2,0,0,0,0|1,0,0]=3 771 B9R1.2 COC1=NC=CC(=C1)Cl Z1201623697 [0,2,0,0,0,0|2,0,0]=4 772 B9R1.2 CSC1=CC(=CC=C1)N Z104472758 [0,2,0,0,0,0|1,0,0]=3 773 B9R1.2 CSC1=CC(=CN=C1)N Z2239020735 [0,2,0,0,0,0|0,0,0]=2 774 B9R1.2 CSC1=CC(=NC=C1)Cl Z1157653499 [0,2,0,0,0,0|2,0,0]=4 775 B9R1.2 CSC1=CC(=NC=C1)N Z1203581667 [0,2,0,0,0,0|2,0,0]=4 776 B9R1.2 CSC1=NC(=CN=C1)Cl Z732207920 [0,2,0,0,0,0|1,0,0]=3 777 B9R1.2 CSC1=NC(=CN=N1)C Z1255426895 [0,2,0,0,0,0|2,0,0]=4 778 B9R1.2 CSC1=NC=CC(=C1)N Z851811592 [0,2,0,0,0,0|2,0,0]=4 779 B9R1.2 CSC1=NC=CC(=C1)O Z1255421960 [0,2,0,0,0,0|2,0,0]=4 780 B9R1.2 CSC1=NN=CC(=O)N1 Z276550462 [0,2,0,0,0,0|2,0,0]=4 781 B9R1.2 ClCC1=CC(=CN=C1)Br Z381037204 [0,2,0,0,0,0|0,0,0]=2 782 B9R1.2 ClCC1=NC(=CN=C1)Cl Z1255357868 [0,2,0,0,0,0|1,0,0]=3 783 B9R1.2 N#CC1=CC(=NN=C1)Cl Z1813120947 [0,2,0,0,0,0|1,0,1]=4 784 B9R1.2 N#CC1=CC(=NN=C1)F Z2568988299 [0,2,0,0,0,0|1,0,1]=4 785 B9R1.2 N#CC1=CC=CC(=C1)Br Z57899727 [0,2,0,0,0,0|1,0,1]=4 786 B9R1.2 N#CC1=CC=CC(=C1)I Z57899724 [0,2,0,0,0,0|1,0,1]=4 787 B9R1.2 N#CC1=CC=CC(=C1)N Z104477194 [0,2,0,0,0,0|1,0,1]=4 788 B9R1.2 N#CC1=CC=CC(=C1)O Z56969327 [0,2,0,0,0,0|1,0,1]=4 789 B9R1.2 N#CC1=CN=CC(=C1)Br Z1079179144 [0,2,0,0,0,0|0,0,1]=3 790 B9R1.2 N#CC1=CN=CC(=C1)Cl Z1198162033 [0,2,0,0,0,0|0,0,1]=3 791 B9R1.2 N#CC1=CN=CC(=C1)F Z1201624890 [0,2,0,0,0,0|0,0,1]=3 792 B9R1.2 N#CC1=CN=CC(=C1)O Z1198307115 [0,2,0,0,0,0|0,0,1]=3 793 B9R1.2 N#CC1=CN=CC(=N1)Br Z1165304242 [0,2,0,0,0,0|1,0,1]=4 794 B9R1.2 N#CC1=CN=CC(=N1)Cl Z1165304152 [0,2,0,0,0,0|1,0,1]=4 795 B9R1.2 N#CC1=CN=CC(=N1)F Z1681360134 [0,2,0,0,0,0|1,0,1]=4 796 B9R1.2 NC1=CC(=NC=C1)CO Z1198310848 [0,2,0,0,0,0|2,0,0]=4 797 B9R1.2 NC1=NC(=CC=C1)CO Z154209994 [0,2,0,0,0,0|2,0,0]=4 798 B9R1.2 NC1=NC(=CN=C1)CO Z1203641562 [0,2,0,0,0,0|1,0,0]=3 799 B9R1.2 NC1=NC=CC(=C1)CO Z991492364 [0,2,0,0,0,0|2,0,0]=4 800 B9R1.2 NCC1=CC(=CC=C1)Br Z1262246228 [0,2,0,0,0,0|1,0,0]=3 801 B9R1.2 NCC1=CC(=CC=C1)I Z1269220799 [0,2,0,0,0,0|1,0,0]=3 802 B9R1.2 NCC1=CC(=CC=C1)O Z744729056 [0,2,0,0,0,0|1,0,0]=3 803 B9R1.2 NCC1=CC(=CN=C1)Br Z2692250391 [0,2,0,0,0,0|0,0,0]=2 804 B9R1.2 NCC1=CC(=CN=C1)Cl Z3244925674 [0,2,0,0,0,0|0,0,0]=2 805 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [0,2,0,0,0,0|0,0,0]=2 806 B9R1.2 NCC1=NC(=CC=C1)N Z2310698959 [0,2,0,0,0,0|2,0,0]=4 807 B9R1.2 NCC1=NC(=CN=C1)Cl Z3235038825 [0,2,0,0,0,0|1,0,0]=3 808 B9R1.2 NCC1=NC=CC(=C1)Cl Z1198173013 [0,2,0,0,0,0|2,0,0]=4 809 B9R1.2 NCC1=NC=CC(=C1)N Z2310678270 [0,2,0,0,0,0|2,0,0]=4 810 B9R1.2 NNC1=CC(=CC=C1)Br Z118530090 [0,2,0,0,0,0|2,0,0]=4 811 B9R1.2 NNC1=CC(=CC=C1)Cl Z56940998 [0,2,0,0,0,0|2,0,0]=4 812 B9R1.2 NNC1=NC(=CN=C1)Cl Z319443864 [0,2,0,0,0,0|2,0,0]=4 813 B9R1.2 O=C1C=C(C=CN1)CO Z1203733303 [0,2,0,0,0,0|2,0,0]=4 814 B9R1.2 O=CC1=CC=CC(=C1)Br Z104472918 [0,2,0,0,0,0|1,0,1]=4 815 B9R1.2 O=CC1=CC=CC(=C1)Cl Z104476504 [0,2,0,0,0,0|1,0,1]=4 816 B9R1.2 O=CC1=CC=CC(=C1)F Z104476574 [0,2,0,0,0,0|1,0,1]=4 817 B9R1.2 O=CC1=CC=CC(=C1)I Z57887683 [0,2,0,0,0,0|1,0,1]=4 818 B9R1.2 O=CC1=CC=CC(=C1)O Z57772446 [0,2,0,0,0,0|1,0,1]=4 819 B9R1.2 O=CC1=CC=CC(=C1)S Z969587160 [0,2,0,0,0,0|1,0,1]=4 820 B9R1.2 O=CC1=CN=CC(=C1)Br Z1079442626 [0,2,0,0,0,0|0,0,1]=3 821 B9R1.2 O=CC1=CN=CC(=C1)Cl Z1198179591 [0,2,0,0,0,0|0,0,1]=3 822 B9R1.2 O=CC1=CN=CC(=C1)F Z1183458945 [0,2,0,0,0,0|0,0,1]=3 823 B9R1.2 OC1=CC(=CC=C1)CCl Z1198169502 [0,2,0,0,0,0|1,0,0]=3 824 B9R1.2 OCC1=CC(=CC=C1)Br Z335244752 [0,2,0,0,0,0|1,0,0]=3 825 B9R1.2 OCC1=CC(=CC=C1)Cl Z212055560 [0,2,0,0,0,0|1,0,0]=3 826 B9R1.2 OCC1=CC(=CC=C1)F Z104477458 [0,2,0,0,0,0|1,0,0]=3 827 B9R1.2 OCC1=CC(=CC=C1)O Z335245000 [0,2,0,0,0,0|1,0,0]=3 828 B9R1.2 OCC1=CC(=CN=C1)Br Z381037198 [0,2,0,0,0,0|0,0,0]=2 829 B9R1.2 OCC1=CC(=NC=C1)Cl Z979439344 [0,2,0,0,0,0|2,0,0]=4 830 B9R1.2 OCC1=NC(=CC=C1)O Z1198343459 [0,2,0,0,0,0|2,0,0]=4 831 B9R1.2 OCC1=NC=CC(=C1)Cl Z979714554 [0,2,0,0,0,0|2,0,0]=4 832 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [0,2,0,0,0,0|1,0,0]=3 833 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [0,2,0,0,0,0|0,0,0]=2 834 B9R1.6 CC(=O)C1=CN=CN=C1 Z992240312 [0,2,0,0,0,0|1,0,0]=3 835 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [0,2,0,0,0,0|2,0,0]=4 836 B9R1.6 CC(=O)C1=NC=CN=C1 Z513735920 [0,2,0,0,0,0|1,0,0]=3 837 B9R1.6 CC(=O)C1=NN=CC=C1 Z1255432788 [0,2,0,0,0,0|1,0,0]=3 838 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [0,2,0,0,0,0|2,0,0]=4 839 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [0,2,0,0,0,0|1,0,0]=3 840 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [0,2,0,0,0,0|0,0,0]=2 841 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [0,2,0,0,0,0|2,0,0]=4 842 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [0,2,0,0,0,0|1,0,0]=3 843 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [0,2,0,0,0,0|2,0,0]=4 844 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [0,2,0,0,0,0|0,0,0]=2 845 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [0,2,0,0,0,0|1,0,0]=3 847 B9R1.6 CN(C)C1=CC=NC=C1 Z104478964 [0,2,0,0,0,0|2,0,0]=4 848 B9R1.6 CN(C)C1=CN=CC=C1 Z1201619922 [0,2,0,0,0,0|0,0,0]=2 849 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [0,2,0,0,0,0|1,0,0]=3 850 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [0,2,0,0,0,0|1,0,0]=3 851 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [0,2,0,0,0,0|2,0,0]=4 852 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [0,2,0,0,0,0|1,0,0]=3 853 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [0,2,0,0,0,0|1,0,0]=3 854 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [0,2,0,0,0,0|2,0,0]=4 855 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [0,2,0,0,0,0|1,0,0]=3 856 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [0,2,0,0,0,0|1,0,1]=4 857 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [0,2,0,0,0,0|0,0,1]=3 858 B9R1.6 N=C(N)C1=CN=CN=C1 Z1741981975 [0,2,0,0,0,0|1,0,1]=4 859 B9R1.6 N=C(N)C1=NC=CN=C1 Z1741973428 [0,2,0,0,0,0|1,0,1]=4 860 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [0,2,0,0,0,0|0,0,1]=3 861 B9R1.6 NC(=O)C1=CN=NC=C1 Z1203579431 [0,2,0,0,0,0|1,0,1]=4 862 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [0,2,0,0,0,0|1,0,1]=4 863 B9R1.6 NC(=O)C1=NN=CC=C1 Z1203580134 [0,2,0,0,0,0|1,0,1]=4 864 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [0,2,0,0,0,0|1,0,1]=4 865 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [0,2,0,0,0,0|0,0,1]=3 866 B9R1.6 NC(=S)C1=NC=CN=C1 Z234895463 [0,2,0,0,0,0|1,0,1]=4 867 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [0,2,0,0,0,0|1,0,1]=4 868 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [0,2,0,0,0,0|0,0,1]=3 869 B9R1.6 O=C(O)C1=CN=CN=C1 Z336079948 [0,2,0,0,0,0|1,0,1]=4 870 B9R1.6 O=C(O)C1=CN=NC=C1 Z1182328443 [0,2,0,0,0,0|1,0,1]=4 871 B9R1.6 O=C(O)C1=NC=CN=C1 Z104476002 [0,2,0,0,0,0|1,0,1]=4 872 B9R1.6 O=C(O)C1=NN=CC=C1 Z1201621268 [0,2,0,0,0,0|1,0,1]=4 873 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [0,2,0,0,0,0|2,0,0]=4 874 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [0,2,0,0,0,0|2,0,0]=4 875 B9R1.6 OB(O)C1=CN=CC=C1 Z608482642 [0,2,0,0,0,0|1,0,0]=3 876 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,2,0,0,0,0|1,0,0]=3 877 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [0,2,0,0,0,0|1,0,0]=3 879 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [0,2,0,0,0,0|1,0,0]=3 880 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [0,2,0,0,0,0|2,0,0]=4 881 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [0,2,0,0,0,0|0,0,0]=2 882 B9R1.8 CCNC1=NN=CC=C1 Z991530898 [0,2,0,0,0,0|1,0,0]=3 883 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [0,2,0,0,0,0|2,0,0]=4 885 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [0,2,0,0,0,0|0,0,0]=2 886 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [0,2,0,0,0,0|1,0,0]=3 887 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [0,2,0,0,0,0|0,0,0]=2 888 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [0,2,0,0,0,0|0,0,0]=2 889 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [0,2,0,0,0,0|2,0,0]=4 890 B9R1.8 N#CCC1=NC=CN=C1 Z1098233793 [0,2,0,0,0,0|1,0,0]=3 891 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [0,2,0,0,0,0|1,0,1]=4 892 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [0,2,0,0,0,0|2,0,0]=4 893 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [0,2,0,0,0,0|0,0,0]=2 894 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [0,2,0,0,0,0|1,0,0]=3 895 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [0,2,0,0,0,0|2,0,0]=4 896 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [0,2,0,0,0,0|1,0,0]=3 897 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [0,2,0,0,0,0|1,0,0]=3 898 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [0,2,0,0,0,0|0,0,0]=2 899 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [0,2,0,0,0,0|1,0,0]=3 900 B9R1.8 O/N=C/C1=NN=CC=C1 Z1726150759 [0,2,0,0,0,0|1,0,1]=4 901 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [0,2,0,0,0,0|1,0,0]=3 902 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [0,2,0,0,0,0|1,0,0]=3 903 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,2,0,0,0,0|0,0,0]=2 904 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,2,0,0,0,0|2,0,0]=4 905 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [0,2,0,0,0,0|1,0,0]=3 906 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [0,2,0,0,0,0|1,0,1]=4 907 B9R1.15 BrCC1=C(C=CC=C1)Br Z56969700 [0,2,0,0,0,0|1,0,0]=3 908 B9R1.15 C#CC1=C(C=CC=C1)Cl Z1080385584 [0,2,0,0,0,0|1,0,1]=4 909 B9R1.15 C#CC1=C(C=CC=C1)F Z1080385538 [0,2,0,0,0,0|1,0,1]=4 910 B9R1.15 C#CC1=C(N=CC=N1)Cl Z1258977238 [0,2,0,0,0,0|1,0,1]=4 911 B9R1.15 C=CC1=C(C=CC=C1)Cl Z957339910 [0,2,0,0,0,0|1,0,1]=4 912 B9R1.15 CC1=C(C=CC=C1)C=O Z104478122 [0,2,0,0,0,0|1,0,0]=3 913 B9R1.15 CC1=C(C=CC=C1)CO Z335244790 [0,2,0,0,0,0|1,0,0]=3 914 B9R1.15 CC1=C(C=CC=C1)NN Z56933829 [0,2,0,0,0,0|1,0,0]=3 915 B9R1.15 CC1=C(C=CC=N1)C#N Z1198168592 [0,2,0,0,0,0|0,0,1]=3 916 B9R1.15 CC1=C(C=CC=N1)C=O Z1104852897 [0,2,0,0,0,0|0,0,1]=3 917 B9R1.15 CC1=C(C=CN=C1)C#N Z382716050 [0,2,0,0,0,0|0,0,0]=2 918 B9R1.15 CC1=C(C=CN=C1)C=O Z1201621679 [0,2,0,0,0,0|0,0,0]=2 919 B9R1.15 CC1=C(C=CN=C1)CO Z1198163942 [0,2,0,0,0,0|0,0,0]=2 920 B9R1.15 CC1=C(C=NC=C1)C=O Z1198173330 [0,2,0,0,0,0|0,0,1]=3 921 B9R1.15 CC1=C(C=NC=C1)CO Z1198156922 [0,2,0,0,0,0|0,0,0]=2 922 B9R1.15 CC1=C(C=NC=N1)C#N Z1263714352 [0,2,0,0,0,0|1,0,1]=4 923 B9R1.15 CC1=C(N=CC=C1)C#N Z382716046 [0,2,0,0,0,0|0,0,0]=2 924 B9R1.15 CC1=C(N=CC=C1)C=O Z1079442732 [0,2,0,0,0,0|0,0,0]=2 925 B9R1.15 CC1=C(N=CC=C1)CO Z976637084 [0,2,0,0,0,0|0,0,0]=2 926 B9R1.15 CC1=C(N=CC=N1)C#N Z1198181979 [0,2,0,0,0,0|1,0,0]=3 927 B9R1.15 CC1=C(N=CC=N1)C=O Z1198233269 [0,2,0,0,0,0|1,0,0]=3 928 B9R1.15 CC1=C(N=CC=N1)CN Z3671696702 [0,2,0,0,0,0|1,0,0]=3 929 B9R1.15 CC1=C(N=CN=C1)C#N Z1216842029 [0,2,0,0,0,0|1,0,0]=3 930 B9R1.15 CC1=C(N=CN=C1)C=O Z1198279991 [0,2,0,0,0,0|1,0,0]=3 931 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [0,2,0,0,0,0|1,0,0]=3 932 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [0,2,0,0,0,0|1,0,0]=3 933 B9R1.15 CCC1=C(C=NC=C1)N Z1203586904 [0,2,0,0,0,0|1,0,0]=3 934 B9R1.15 CCC1=C(C=NC=N1)O Z1618133826 [0,2,0,0,0,0|2,0,0]=4 935 B9R1.15 CCC1=C(N=CC=C1)N Z1192017773 [0,2,0,0,0,0|0,0,0]=2 936 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [0,2,0,0,0,0|0,0,0]=2 937 B9R1.15 CCC1=C(N=CC=N1)Cl Z1198149374 [0,2,0,0,0,0|1,0,0]=3 938 B9R1.15 CCC1=C(N=CC=N1)N Z1203580180 [0,2,0,0,0,0|1,0,0]=3 939 B9R1.15 CCC1=CNC=CC1=N Z1525649973 [0,2,0,0,0,0|0,0,1]=3 940 B9R1.15 CCC1=NC=CNC1=O Z3274889193 [0,2,0,0,0,0|1,0,1]=4 941 B9R1.15 CCC1=NNC=NC1=O Z1201628993 [0,2,0,0,0,0|2,0,0]=4 942 B9R1.15 CC[N+]1=C(C=CC=C1)N Z56791107 [0,2,0,0,0,0|2,0,0]=4 943 B9R1.15 CNC1=C(C=CC=C1)Br Z2588063702 [0,2,0,0,0,0|1,0,0]=3 944 B9R1.15 CNC1=C(C=CC=C1)F Z335276746 [0,2,0,0,0,0|1,0,0]=3 945 B9R1.15 CNC1=C(C=CC=C1)N Z57472969 [0,2,0,0,0,0|1,0,0]=3 946 B9R1.15 CNC1=C(C=CC=N1)Br Z808603280 [0,2,0,0,0,0|1,0,0]=3 947 B9R1.15 CNC1=C(C=CC=N1)C Z968907582 [0,2,0,0,0,0|0,0,0]=2 948 B9R1.15 CNC1=C(C=CC=N1)F Z997723632 [0,2,0,0,0,0|1,0,0]=3 949 B9R1.15 CNC1=C(C=CC=N1)N Z803145504 [0,2,0,0,0,0|1,0,0]=3 950 B9R1.15 CNC1=C(C=CN=C1)C Z1124504699 [0,2,0,0,0,0|0,0,0]=2 951 B9R1.15 CNC1=C(C=NC=C1)Br Z1198175026 [0,2,0,0,0,0|1,0,0]=3 952 B9R1.15 CNC1=C(C=NC=C1)C Z1147200119 [0,2,0,0,0,0|0,0,0]=2 953 B9R1.15 CNC1=C(C=NC=C1)F Z1946124201 [0,2,0,0,0,0|1,0,0]=3 954 B9R1.15 CNC1=C(C=NC=C1)N Z57396117 [0,2,0,0,0,0|1,0,0]=3 955 B9R1.15 CNC1=C(C=NC=N1)F Z1681383887 [0,2,0,0,0,0|2,0,0]=4 956 B9R1.15 CNC1=C(C=NC=N1)I Z1269149847 [0,2,0,0,0,0|2,0,0]=4 957 B9R1.15 CNC1=C(C=NN=C1)Br Z3665297219 [0,2,0,0,0,0|1,0,0]=3 958 B9R1.15 CNC1=C(N=CC=C1)C Z1295808975 [0,2,0,0,0,0|0,0,0]=2 959 B9R1.15 CNC1=C(N=CC=C1)N Z1203578357 [0,2,0,0,0,0|0,0,0]=2 960 B9R1.15 CNC1=C(N=CC=N1)C Z2768516750 [0,2,0,0,0,0|1,0,0]=3 961 B9R1.15 CNC1=CNC=CC1=N Z2130740350 [0,2,0,0,0,0|0,0,1]=3 962 B9R1.15 COC1=C(C=CC=C1)F Z54600290 [0,2,0,0,0,0|1,0,0]=3 963 B9R1.15 COC1=C(C=CC=C1)O Z104474028 [0,2,0,0,0,0|1,0,0]=3 964 B9R1.15 COC1=C(C=CC=N1)N Z240084308 [0,2,0,0,0,0|1,0,0]=3 965 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [0,2,0,0,0,0|1,0,0]=3 966 B9R1.15 COC1=C(C=CN=N1)N Z2146515312 [0,2,0,0,0,0|1,0,0]=3 967 B9R1.15 COC1=C(C=NC=C1)Br Z1198165840 [0,2,0,0,0,0|1,0,0]=3 968 B9R1.15 COC1=C(C=NC=C1)N Z359373528 [0,2,0,0,0,0|1,0,0]=3 969 B9R1.15 COC1=C(C=NC=N1)Br Z1272130999 [0,2,0,0,0,0|2,0,0]=4 970 B9R1.15 COC1=C(C=NC=N1)I Z1269172401 [0,2,0,0,0,0|2,0,0]=4 971 B9R1.15 COC1=C(C=NC=N1)N Z1198222304 [0,2,0,0,0,0|2,0,0]=4 972 B9R1.15 COC1=C(N=CC=C1)C Z1198150814 [0,2,0,0,0,0|0,0,0]=2 973 B9R1.15 COC1=C(N=CC=C1)N Z362783902 [0,2,0,0,0,0|0,0,0]=2 974 B9R1.15 COC1=C(N=CC=N1)N Z1198166025 [0,2,0,0,0,0|1,0,0]=3 975 B9R1.15 COC1=C(N=CN=C1)N Z1201621261 [0,2,0,0,0,0|1,0,0]=3 976 B9R1.15 COC1=CC=CNC1=O Z2678251321 [0,2,0,0,0,0|0,0,1]=3 977 B9R1.15 CSC1=C(C=CC=C1)C Z785054008 [0,2,0,0,0,0|1,0,0]=3 978 B9R1.15 CSC1=C(C=CC=C1)N Z104478220 [0,2,0,0,0,0|1,0,0]=3 979 B9R1.15 CSC1=C(C=CC=N1)Br Z808605456 [0,2,0,0,0,0|1,0,0]=3 980 B9R1.15 CSC1=C(C=NC=C1)N Z412017790 [0,2,0,0,0,0|1,0,0]=3 981 B9R1.15 CSC1=C(N=CC=C1)N Z1203640622 [0,2,0,0,0,0|0,0,0]=2 982 B9R1.15 ClCC1=C(N=CC=N1)Cl Z934373154 [0,2,0,0,0,0|1,0,0]=3 983 B9R1.15 N#CC1=C(C=CC=C1)Br Z57899728 [0,2,0,0,0,0|1,0,1]=4 984 B9R1.15 N#CC1=C(C=CC=C1)Cl Z57756581 [0,2,0,0,0,0|1,0,1]=4 985 B9R1.15 N#CC1=C(C=CC=C1)I Z57899723 [0,2,0,0,0,0|1,0,1]=4 986 B9R1.15 N#CC1=C(C=CC=C1)N Z104478174 [0,2,0,0,0,0|1,0,1]=4 987 B9R1.15 N#CC1=C(C=CC=C1)O Z104477750 [0,2,0,0,0,0|1,0,1]=4 988 B9R1.15 N#CC1=C(C=CC=N1)N Z2756841900 [0,2,0,0,0,0|1,0,0]=3 989 B9R1.15 N#CC1=C(C=CN=C1)Cl Z1198176516 [0,2,0,0,0,0|0,0,1]=3 990 B9R1.15 N#CC1=C(C=CN=C1)N Z1083213944 [0,2,0,0,0,0|0,0,1]=3 991 B9R1.15 N#CC1=C(C=CN=C1)S Z2513333613 [0,2,0,0,0,0|0,0,1]=3 992 B9R1.15 N#CC1=C(C=NC=C1)Br Z1201619912 [0,2,0,0,0,0|1,0,0]=3 993 B9R1.15 N#CC1=C(C=NC=C1)Cl Z1201623149 [0,2,0,0,0,0|1,0,0]=3 994 B9R1.15 N#CC1=C(C=NC=C1)F Z1198164101 [0,2,0,0,0,0|1,0,0]=3 995 B9R1.15 N#CC1=C(C=NC=C1)O Z1255404294 [0,2,0,0,0,0|1,0,0]=3 996 B9R1.15 N#CC1=C(C=NC=N1)Cl Z1255394185 [0,2,0,0,0,0|2,0,0]=4 997 B9R1.15 N#CC1=C(N=CC=C1)N Z295203364 [0,2,0,0,0,0|0,0,1]=3 998 B9R1.15 N#CC1=C(N=CC=N1)Br Z995020080 [0,2,0,0,0,0|1,0,1]=4 999 B9R1.15 N#CC1=C(N=CC=N1)Cl Z992759282 [0,2,0,0,0,0|1,0,1]=4 1000 B9R1.15 N#CC1=C(N=CC=N1)N Z995018904 [0,2,0,0,0,0|1,0,1]=4 1001 B9R1.15 N#CC1=C(N=CC=N1)O Z995023286 [0,2,0,0,0,0|1,0,1]=4 1002 B9R1.15 N#CC1=C(N=CN=C1)Cl Z1198152547 [0,2,0,0,0,0|1,0,1]=4 1003 B9R1.15 N#CC1=C(N=CN=C1)N Z277468404 [0,2,0,0,0,0|1,0,1]=4 1004 B9R1.15 N#CC1=C(N=NC=C1)Cl Z1198305222 [0,2,0,0,0,0|1,0,1]=4 1005 B9R1.15 N#CC1=C(N=NC=C1)F Z2568988202 [0,2,0,0,0,0|1,0,1]=4 1006 B9R1.15 N#CC1=CC=CNC1=O Z316174630 [0,2,0,0,0,0|0,0,2]=4 1007 B9R1.15 N#CC1=CN=CNC1=O Z2065464281 [0,2,0,0,0,0|1,0,1]=4 1008 B9R1.15 N#CC1=CNC=CC1=O Z1198308056 [0,2,0,0,0,0|0,0,2]=4 1009 B9R1.15 NC1=C(C=CC=C1)C=O Z3034936011 [0,2,0,0,0,0|1,0,1]=4 1010 B9R1.15 NC1=C(C=CC=C1)CO Z104495736 [0,2,0,0,0,0|1,0,0]=3 1011 B9R1.15 NC1=C(C=CC=N1)C=O Z787969952 [0,2,0,0,0,0|0,0,1]=3 1012 B9R1.15 NC1=C(C=CN=C1)C=O Z1741972771 [0,2,0,0,0,0|1,0,0]=3 1013 B9R1.15 NC1=C(C=CN=C1)CO Z1201623606 [0,2,0,0,0,0|1,0,0]=3 1014 B9R1.15 NC1=C(C=NC=C1)C=O Z1157726300 [0,2,0,0,0,0|0,0,1]=3 1015 B9R1.15 NC1=C(C=NC=N1)C=O Z3244817347 [0,2,0,0,0,0|1,0,1]=4 1016 B9R1.15 NC1=C(C=NC=N1)CO Z1198223533 [0,2,0,0,0,0|1,0,0]=3 1017 B9R1.15 NC1=C(N=CC=N1)CO Z1198237691 [0,2,0,0,0,0|1,0,0]=3 1018 B9R1.15 NCC1=C(C=CC=C1)Cl Z55002587 [0,2,0,0,0,0|1,0,0]=3 1019 B9R1.15 NCC1=C(C=CC=C1)I Z2574934431 [0,2,0,0,0,0|1,0,0]=3 1020 B9R1.15 NCC1=C(C=CC=C1)O Z993991142 [0,2,0,0,0,0|1,0,0]=3 1021 B9R1.15 NCC1=C(C=CC=N1)F Z1575304378 [0,2,0,0,0,0|1,0,0]=3 1022 B9R1.15 NCC1=C(C=CC=N1)N Z1198181626 [0,2,0,0,0,0|1,0,0]=3 1023 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [0,2,0,0,0,0|1,0,0]=3 1024 B9R1.15 NCC1=C(C=CN=C1)Cl Z3386909551 [0,2,0,0,0,0|0,0,0]=2 1025 B9R1.15 NCC1=C(C=CN=C1)N Z1742055036 [0,2,0,0,0,0|0,0,0]=2 1026 B9R1.15 NCC1=C(C=NC=C1)Br Z2731710898 [0,2,0,0,0,0|1,0,0]=3 1027 B9R1.15 NCC1=C(N=CC=N1)Cl Z2472857434 [0,2,0,0,0,0|1,0,0]=3 1028 B9R1.15 NCC1=C(N=CN=C1)N Z1456202381 [0,2,0,0,0,0|1,0,0]=3 1029 B9R1.15 NNC1=C(C=CC=C1)Br Z216309278 [0,2,0,0,0,0|2,0,0]=4 1030 B9R1.15 NNC1=C(C=CC=C1)Cl Z56928643 [0,2,0,0,0,0|2,0,0]=4 1031 B9R1.15 NNC1=C(C=CC=C1)F Z220383458 [0,2,0,0,0,0|2,0,0]=4 1032 B9R1.15 NNC1=C(C=CC=N1)N Z1203148325 [0,2,0,0,0,0|1,0,0]=3 1033 B9R1.15 O=CC1=C(C=CC=C1)Br Z104478338 [0,2,0,0,0,0|1,0,1]=4 1034 B9R1.15 O=CC1=C(C=CC=C1)Cl Z104472866 [0,2,0,0,0,0|1,0,1]=4 1035 B9R1.15 O=CC1=C(C=CC=C1)F Z104476570 [0,2,0,0,0,0|1,0,1]=4 1036 B9R1.15 O=CC1=C(C=CC=C1)I Z56899024 [0,2,0,0,0,0|1,0,1]=4 1037 B9R1.15 O=CC1=C(C=CC=C1)O Z57127523 [0,2,0,0,0,0|1,0,1]=4 1038 B9R1.15 O=CC1=C(C=CC=N1)Br Z1201624233 [0,2,0,0,0,0|1,0,0]=3 1039 B9R1.15 O=CC1=C(C=CC=N1)Cl Z1198267206 [0,2,0,0,0,0|1,0,0]=3 1040 B9R1.15 O=CC1=C(C=CC=N1)F Z1201624236 [0,2,0,0,0,0|1,0,0]=3 1041 B9R1.15 O=CC1=C(C=CC=N1)O Z1201623419 [0,2,0,0,0,0|1,0,0]=3 1042 B9R1.15 O=CC1=C(C=CN=C1)Br Z1201623579 [0,2,0,0,0,0|0,0,1]=3 1043 B9R1.15 O=CC1=C(C=CN=C1)Cl Z1198164100 [0,2,0,0,0,0|0,0,1]=3 1044 B9R1.15 O=CC1=C(C=CN=C1)O Z1198277591 [0,2,0,0,0,0|0,0,1]=3 1045 B9R1.15 O=CC1=C(C=NC=C1)Br Z1192338771 [0,2,0,0,0,0|1,0,0]=3 1046 B9R1.15 O=CC1=C(C=NC=C1)Cl Z1255391336 [0,2,0,0,0,0|1,0,0]=3 1047 B9R1.15 O=CC1=C(C=NC=C1)F Z1203162407 [0,2,0,0,0,0|1,0,0]=3 1048 B9R1.15 O=CC1=CC=CNC1=O Z1198173495 [0,2,0,0,0,0|0,0,2]=4 1049 B9R1.15 OCC1=C(C=CC=C1)Br Z335245004 [0,2,0,0,0,0|1,0,0]=3 1050 B9R1.15 OCC1=C(C=CC=C1)Cl Z104476786 [0,2,0,0,0,0|1,0,0]=3 1051 B9R1.15 OCC1=C(C=CC=C1)F Z104495204 [0,2,0,0,0,0|1,0,0]=3 1052 B9R1.15 OCC1=C(C=CC=C1)I Z57472670 [0,2,0,0,0,0|1,0,0]=3 1053 B9R1.15 OCC1=C(C=CC=C1)O Z335244902 [0,2,0,0,0,0|1,0,0]=3 1054 B9R1.15 OCC1=C(C=CN=C1)Cl Z1741982140 [0,2,0,0,0,0|0,0,0]=2 1055 B9R1.15 OCC1=C(C=NC=C1)Cl Z1198261848 [0,2,0,0,0,0|1,0,0]=3 1056 B9R1.15 OCC1=C(C=NC=C1)F Z1251273325 [0,2,0,0,0,0|1,0,0]=3 1057 B9R1.15 OCC1=C(N=CC=C1)Cl Z979431808 [0,2,0,0,0,0|0,0,0]=2 1058 B9R1.15 SCC1=C(C=CC=C1)Cl Z55948221 [0,2,0,0,0,0|1,0,0]=3 1059 B9R1.69 BrC1=CC(=C(C=C1)Br)I Z819231684 [0,2,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=C(C=C(C=C1)Cl)N Z104479890 [0,2,0,0,0,0|1,0,0]=3 1061 B9R1.69 CC1=C(C=C(C=C1)Cl)O Z384970604 [0,2,0,0,0,0|1,0,0]=3 1062 B9R1.69 CC1=C(C=C(C=C1)F)Br Z168880596 [0,2,0,0,0,0|1,0,0]=3 1063 B9R1.69 CC1=C(C=C(C=C1)F)N Z104477984 [0,2,0,0,0,0|1,0,0]=3 1064 B9R1.69 CC1=C(C=C(C=C1)I)N Z414834730 [0,2,0,0,0,0|1,0,0]=3 1065 B9R1.69 CC1=C(C=C(C=C1)N)Br Z285720874 [0,2,0,0,0,0|1,0,0]=3 1066 B9R1.69 CC1=C(C=C(C=C1)N)C Z104472552 [0,2,0,0,0,0|1,0,0]=3 1067 B9R1.69 CC1=C(C=C(C=C1)N)Cl Z57127543 [0,2,0,0,0,0|1,0,0]=3 1068 B9R1.69 CC1=C(C=C(C=C1)N)F Z104477330 [0,2,0,0,0,0|1,0,0]=3 1069 B9R1.69 CC1=C(C=C(C=C1)N)I Z56926636 [0,2,0,0,0,0|1,0,0]=3 1070 B9R1.69 CC1=C(C=C(C=C1)N)N Z57825344 [0,2,0,0,0,0|1,0,0]=3 1071 B9R1.69 CC1=C(C=C(C=C1)N)O Z944939438 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.69 CC1=C(C=C(C=C1)O)C Z104477218 [0,2,0,0,0,0|1,0,0]=3 1073 B9R1.69 CC1=C(C=C(C=N1)Br)N Z1198183234 [0,2,0,0,0,0|1,0,0]=3 1074 B9R1.69 CC1=C(C=C(C=N1)Br)O Z1255428492 [0,2,0,0,0,0|1,0,0]=3 1075 B9R1.69 CC1=C(C=C(C=N1)N)Br Z1198175716 [0,2,0,0,0,0|1,0,0]=3 1076 B9R1.69 CC1=C(C=C(C=N1)O)Br Z1198234267 [0,2,0,0,0,0|1,0,0]=3 1077 B9R1.69 CC1=C(C=C(N=C1)N)C Z1198182514 [0,2,0,0,0,0|0,0,0]=2 1078 B9R1.69 CC1=C(C=C(N=N1)Cl)Cl Z1258850959 [0,2,0,0,0,0|1,0,0]=3 1079 B9R1.69 CC1=C(C=CC(=C1)Br)Br Z1262253894 [0,2,0,0,0,0|1,0,0]=3 1080 B9R1.69 CC1=C(C=CC(=C1)Br)I Z1269231220 [0,2,0,0,0,0|1,0,0]=3 1081 B9R1.69 CC1=C(C=CC(=C1)Br)O Z57203793 [0,2,0,0,0,0|1,0,0]=3 1082 B9R1.69 CC1=C(C=CC(=C1)Cl)N Z104474180 [0,2,0,0,0,0|1,0,0]=3 1083 B9R1.69 CC1=C(C=CC(=C1)Cl)O Z104477908 [0,2,0,0,0,0|1,0,0]=3 1084 B9R1.69 CC1=C(C=CC(=C1)F)O Z384970672 [0,2,0,0,0,0|1,0,0]=3 1085 B9R1.69 CC1=C(C=CC(=C1)I)N Z56960244 [0,2,0,0,0,0|1,0,0]=3 1086 B9R1.69 CC1=C(C=CC(=C1)N)Br Z104476134 [0,2,0,0,0,0|1,0,0]=3 1087 B9R1.69 CC1=C(C=CC(=C1)N)Cl Z2471262583 [0,2,0,0,0,0|1,0,0]=3 1088 B9R1.69 CC1=C(C=CC(=C1)O)Br Z401597308 [0,2,0,0,0,0|1,0,0]=3 1089 B9R1.69 CC1=C(C=CC(=C1)O)Cl Z104477910 [0,2,0,0,0,0|1,0,0]=3 1090 B9R1.69 CC1=C(C=CC(=C1)O)F Z1021305330 [0,2,0,0,0,0|1,0,0]=3 1091 B9R1.69 CC1=C(C=CC(=C1)O)I Z1269160508 [0,2,0,0,0,0|1,0,0]=3 1092 B9R1.69 CC1=C(C=CC(=N1)Cl)I Z1269206091 [0,2,0,0,0,0|1,0,0]=3 1093 B9R1.69 CC1=C(C=CC(=N1)N)Br Z57376600 [0,2,0,0,0,0|1,0,0]=3 1094 B9R1.69 CC1=C(C=CC(=N1)N)I Z57296056 [0,2,0,0,0,0|1,0,0]=3 1095 B9R1.69 CC1=C(C=CC(=O)N1)Br Z1251353594 [0,2,0,0,0,0|1,0,1]=4 1096 B9R1.69 CC1=C(C=NC(=C1)Br)Br Z1269154884 [0,2,0,0,0,0|1,0,0]=3 1097 B9R1.69 CC1=C(C=NC(=C1)N)I Z1269220565 [0,2,0,0,0,0|1,0,0]=3 1098 B9R1.69 CC1=C(C=NC(=C1)O)I Z1269231181 [0,2,0,0,0,0|1,0,0]=3 1099 B9R1.69 CC1=C(C=NC(=N1)Cl)Br Z1269140027 [0,2,0,0,0,0|2,0,0]=4 1100 B9R1.69 CC1=C(C=NC(=N1)Cl)F Z1255366771 [0,2,0,0,0,0|2,0,0]=4 1101 B9R1.69 CC1=C(C=NC(=N1)Cl)I Z2313106174 [0,2,0,0,0,0|2,0,0]=4 1102 B9R1.69 CC1=C(C=NC(=N1)N)Br Z1198150524 [0,2,0,0,0,0|2,0,0]=4 1103 B9R1.69 CC1=C(N=C(C=N1)Br)C Z1416194403 [0,2,0,0,0,0|1,0,0]=3 1104 B9R1.69 CC1=C(N=C(C=N1)Cl)C Z1255462913 [0,2,0,0,0,0|1,0,0]=3 1105 B9R1.69 CC1=C(N=C(C=N1)Cl)Cl Z1198342669 [0,2,0,0,0,0|1,0,0]=3 1106 B9R1.69 CC1=C(N=C(C=N1)O)C Z1255400771 [0,2,0,0,0,0|1,0,0]=3 1107 B9R1.69 CC1=C(N=C(N=C1)Br)Br Z1269156117 [0,2,0,0,0,0|1,0,0]=3 1108 B9R1.69 CC1=C(N=C(N=C1)Cl)C Z1255505274 [0,2,0,0,0,0|1,0,0]=3 1109 B9R1.69 CC1=C(N=C(N=C1)Cl)Cl Z1255386798 [0,2,0,0,0,0|1,0,0]=3 1110 B9R1.69 CC1=C(N=C(N=C1)Cl)I Z4389848877 [0,2,0,0,0,0|1,0,0]=3 1111 B9R1.69 CC1=C(N=C(N=C1)F)F Z1198725944 [0,2,0,0,0,0|1,0,0]=3 1112 B9R1.69 CC1=C(N=C(N=C1)N)O Z3235158428 [0,2,0,0,0,0|1,0,0]=3 1113 B9R1.69 CC1=C(N=C(N=N1)Cl)C Z1216825228 [0,2,0,0,0,0|2,0,0]=4 1114 B9R1.69 CC1=C(N=C(N=N1)N)C Z1203162685 [0,2,0,0,0,0|2,0,0]=4 1115 B9R1.69 CC1=C(N=C(N=N1)[O-])C Z1696871460 [0,2,0,0,0,0|2,0,0]=4 1116 B9R1.69 CC1=C(N=CC(=C1)Br)Br Z1269220337 [0,2,0,0,0,0|0,0,0]=2 1117 B9R1.69 CC1=C(N=CC(=C1)N)C Z1198174887 [0,2,0,0,0,0|0,0,0]=2 1118 B9R1.69 CC1=C(N=NC(=C1)Br)C Z1813162615 [0,2,0,0,0,0|1,0,0]=3 1119 B9R1.69 CC1=C(N=NC(=C1)Cl)Br Z2651639946 [0,2,0,0,0,0|1,0,0]=3 1120 B9R1.69 CC1=C(N=NC(=C1)Cl)C Z1013743394 [0,2,0,0,0,0|1,0,0]=3 1121 B9R1.69 CC1=C(N=NC(=C1)Cl)Cl Z1203161864 [0,2,0,0,0,0|1,0,0]=3 1122 B9R1.69 CC1=C(N=NC(=C1)N)C Z1013744332 [0,2,0,0,0,0|1,0,0]=3 1123 B9R1.69 CC1=C(N=NC(=C1)O)C Z1258992450 [0,2,0,0,0,0|1,0,0]=3 1124 B9R1.69 CC1=C(N=NC(=C1)O)O Z2379087837 [0,2,0,0,0,0|1,0,0]=3 1125 B9R1.69 CC1=C(N=NC(=C1)S)C Z3003235829 [0,2,0,0,0,0|1,0,0]=3 1126 B9R1.69 CC1=C(N=NC(=N1)Cl)Cl Z1255363674 [0,2,0,0,0,0|2,0,0]=4 1127 B9R1.69 CC1=C(NC(=O)C=C1)N Z3445688575 [0,2,0,0,0,0|0,0,1]=3 1128 B9R1.69 CC1=CC(=C(C=C1)Br)O Z1198311230 [0,2,0,0,0,0|1,0,0]=3 1129 B9R1.69 CC1=CC(=C(C=C1)C)C Z104476700 [0,2,0,0,0,0|1,0,0]=3 1130 B9R1.69 CC1=CC(=C(C=C1)C)N Z57127441 [0,2,0,0,0,0|1,0,0]=3 1131 B9R1.69 CC1=CC(=C(C=C1)C)O Z104477216 [0,2,0,0,0,0|1,0,0]=3 1132 B9R1.69 CC1=CC(=C(C=C1)Cl)N Z1037551050 [0,2,0,0,0,0|1,0,0]=3 1133 B9R1.69 CC1=CC(=C(C=C1)F)Br Z278206772 [0,2,0,0,0,0|1,0,0]=3 1134 B9R1.69 CC1=CC(=C(C=C1)F)N Z104479030 [0,2,0,0,0,0|1,0,0]=3 1135 B9R1.69 CC1=CC(=C(C=C1)F)O Z384970734 [0,2,0,0,0,0|1,0,0]=3 1136 B9R1.69 CC1=CC(=C(C=C1)I)O Z1269144056 [0,2,0,0,0,0|1,0,0]=3 1137 B9R1.69 CC1=CC(=C(C=C1)N)Br Z104477276 [0,2,0,0,0,0|1,0,0]=3 1138 B9R1.69 CC1=CC(=C(C=C1)N)C Z57127436 [0,2,0,0,0,0|1,0,0]=3 1139 B9R1.69 CC1=CC(=C(C=C1)N)Cl Z104474672 [0,2,0,0,0,0|1,0,0]=3 1140 B9R1.69 CC1=CC(=C(C=C1)N)F Z104477648 [0,2,0,0,0,0|1,0,0]=3 1141 B9R1.69 CC1=CC(=C(C=C1)N)N Z394649898 [0,2,0,0,0,0|1,0,0]=3 1142 B9R1.69 CC1=CC(=C(C=C1)O)Cl Z384970658 [0,2,0,0,0,0|1,0,0]=3 1143 B9R1.69 CC1=CC(=C(C=C1)O)I Z1269177064 [0,2,0,0,0,0|1,0,0]=3 1144 B9R1.69 CC1=CC(=C(C=C1)O)N Z394651082 [0,2,0,0,0,0|1,0,0]=3 1145 B9R1.69 CC1=CC(=C(C=C1)O)O Z104490128 [0,2,0,0,0,0|1,0,0]=3 1146 B9R1.69 CC1=CC(=C(N=C1)C)N Z3996549873 [0,2,0,0,0,0|0,0,0]=2 1147 B9R1.69 CC1=CC(=C(N=C1)N)C Z1197891469 [0,2,0,0,0,0|0,0,0]=2 1148 B9R1.69 CC1=CC(=C(N=C1)N)N Z1198163678 [0,2,0,0,0,0|0,0,0]=2 1149 B9R1.69 CC1=CC(=CNC1=O)Br Z1251353012 [0,2,0,0,0,0|0,0,1]=3 1150 B9R1.69 CC1=CC(=CNC1=O)I Z1258842308 [0,2,0,0,0,0|0,0,1]=3 1151 B9R1.69 CC1=CC(=NN=C1Cl)C Z1255433917 [0,2,0,0,0,0|1,0,0]=3 1152 B9R1.69 CC1=CC(=O)C(=CN1)O Z1203733549 [0,2,0,0,0,0|1,0,1]=4 1153 B9R1.69 CC1=CC(=O)C(=CO1)O Z1198164652 [0,2,0,0,0,0|2,0,0]=4 1154 B9R1.69 CC1=CC(=O)C=CC1=O Z57248271 [0,2,0,0,0,0|1,0,0]=3 1155 B9R1.69 CC1=CC(=O)NC=C1Br Z1251353595 [0,2,0,0,0,0|1,0,1]=4 1156 B9R1.69 CC1=CN=C(C=C1N)C Z1203579245 [0,2,0,0,0,0|0,0,0]=2 1157 B9R1.69 CC1=CNC(=O)C(=C1)C Z1203732572 [0,2,0,0,0,0|0,0,1]=3 1158 B9R1.69 CC1=CNC(=O)N=C1N Z1741980467 [0,2,0,0,0,0|1,0,0]=3 1159 B9R1.69 CC1=CNC(=O)NC1=O Z147641104 [0,2,0,0,0,0|1,0,1]=4 1160 B9R1.69 CC1=NC(=C(C=C1)Br)N Z1201622094 [0,2,0,0,0,0|1,0,0]=3 1161 B9R1.69 CC1=NC(=C(C=C1)Br)S Z2739314860 [0,2,0,0,0,0|1,0,0]=3 1162 B9R1.69 CC1=NC(=C(C=C1)N)O Z1198173820 [0,2,0,0,0,0|1,0,0]=3 1163 B9R1.69 CC1=NC(=C(C=C1)O)I Z1269109440 [0,2,0,0,0,0|1,0,0]=3 1164 B9R1.69 CC1=NC(=C(C=C1)O)N Z955136382 [0,2,0,0,0,0|1,0,0]=3 1165 B9R1.69 CC1=NC(=C(C=N1)Br)Cl Z1269223907 [0,2,0,0,0,0|2,0,0]=4 1166 B9R1.69 CC1=NC(=C(C=N1)Br)N Z1198152368 [0,2,0,0,0,0|2,0,0]=4 1167 B9R1.69 CC1=NC(=C(C=N1)C)Br Z2937803268 [0,2,0,0,0,0|1,0,0]=3 1168 B9R1.69 CC1=NC(=C(C=N1)C)Cl Z1198223810 [0,2,0,0,0,0|1,0,0]=3 1169 B9R1.69 CC1=NC(=C(C=N1)C)N Z1198261676 [0,2,0,0,0,0|1,0,0]=3 1170 B9R1.69 CC1=NC(=C(C=N1)F)Cl Z1198233311 [0,2,0,0,0,0|2,0,0]=4 1171 B9R1.69 CC1=NC(=C(C=N1)I)Cl Z1269236794 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.69 CC1=NC(=C(C=N1)N)C Z1198220830 [0,2,0,0,0,0|2,0,0]=4 1173 B9R1.69 CC1=NC(=C(C=N1)O)C Z1255426535 [0,2,0,0,0,0|2,0,0]=4 1174 B9R1.69 CC1=NC(=C(N=C1)C)Cl Z104479244 [0,2,0,0,0,0|1,0,0]=3 1175 B9R1.69 CC1=NC(=C(N=C1)C)F Z2920901477 [0,2,0,0,0,0|1,0,0]=3 1176 B9R1.69 CC1=NC(=C(N=C1)C)N Z1203578739 [0,2,0,0,0,0|1,0,0]=3 1177 B9R1.69 CC1=NC(=C(N=C1)C)O Z1198723414 [0,2,0,0,0,0|1,0,0]=3 1178 B9R1.69 CC1=NC(=C(N=C1)Cl)C Z1201619176 [0,2,0,0,0,0|1,0,0]=3 1179 B9R1.69 CC1=NC=C(C(=O)N1)I Z1695821889 [0,2,0,0,0,0|2,0,0]=4 1180 B9R1.69 CC1=NN=C(C(=C1)Br)Br Z4188724276 [0,2,0,0,0,0|1,0,0]=3 1181 B9R1.69 CC1=NN=C(C(=C1)Br)C Z3377872794 [0,2,0,0,0,0|1,0,0]=3 1182 B9R1.69 CC1=NN=C(C(=C1)Cl)Cl Z1939448554 [0,2,0,0,0,0|1,0,0]=3 1183 B9R1.69 CC1=NN=C(NC1=O)N Z1198160530 [0,2,0,0,0,0|2,0,0]=4 1184 B9R1.69 CC1=NN=C(NC1=O)S Z56887779 [0,2,0,0,0,0|2,0,0]=4 1185 B9R1.69 CC1=NNC(=O)C(=C1)Br Z1198221079 [0,2,0,0,0,0|1,0,1]=4 1186 B9R1.69 CN1C=C(C=CC1=O)Br Z360013150 [0,2,0,0,0,0|1,0,1]=4 1187 B9R1.69 CN1C=C(C=CC1=O)N Z594413772 [0,2,0,0,0,0|1,0,1]=4 1188 B9R1.69 CN1C=CC(=CC1=O)N Z2235810134 [0,2,0,0,0,0|2,0,0]=4 1189 B9R1.69 CN1C=CC(=NC1=O)N Z1198148063 [0,2,0,0,0,0|1,0,0]=3 1190 B9R1.69 CN1C=CC(=O)NC1=O Z154666196 [0,2,0,0,0,0|1,0,1]=4 1191 B9R1.69 CN1C=NC(=CC1=O)N Z1203580737 [0,2,0,0,0,0|1,0,0]=3 1192 B9R1.69 CN1N=CC(=CC1=O)I Z1618126523 [0,2,0,0,0,0|2,0,0]=4 1193 B9R1.69 ClC1=C(C=C(C=C1)Br)Cl Z389927978 [0,2,0,0,0,0|2,0,0]=4 1194 B9R1.69 ClC1=C(C=C(C=C1)I)Cl Z401315340 [0,2,0,0,0,0|2,0,0]=4 1195 B9R1.69 ClC1=CC(=C(C=C1)Cl)Cl Z104478594 [0,2,0,0,0,0|2,0,0]=4 1196 B9R1.69 ClC1=CC(=C(C=C1)I)Cl Z401400338 [0,2,0,0,0,0|2,0,0]=4 1197 B9R1.69 ClC1=CC(=C(N=C1)Cl)Cl Z56771185 [0,2,0,0,0,0|1,0,0]=3 1198 B9R1.69 ClC1=CC(=NN=C1Cl)Cl Z1154360560 [0,2,0,0,0,0|2,0,0]=4 1199 B9R1.69 ClC1=NC(=C(C=C1)Cl)Br Z1269220551 [0,2,0,0,0,0|1,0,0]=3 1200 B9R1.69 ClC1=NC(=C(C=N1)Br)Cl Z1142701237 [0,2,0,0,0,0|2,0,0]=4 1201 B9R1.69 ClC1=NC(=C(C=N1)Cl)Cl Z1203162338 [0,2,0,0,0,0|2,0,0]=4 1202 B9R1.69 ClC1=NC(=C(C=N1)Cl)I Z1269200736 [0,2,0,0,0,0|2,0,0]=4 1203 B9R1.69 ClC1=NC(=C(C=N1)I)Cl Z1269214376 [0,2,0,0,0,0|2,0,0]=4 1204 B9R1.69 FC1=C(C=C(C=C1)Cl)S Z1198342818 [0,2,0,0,0,0|2,0,0]=4 1205 B9R1.69 FC1=C(C=C(C=C1)I)Br Z1269152972 [0,2,0,0,0,0|2,0,0]=4 1206 B9R1.69 FC1=C(C=CC(=C1)Br)Cl Z1269224922 [0,2,0,0,0,0|2,0,0]=4 1207 B9R1.69 FC1=C(C=CC(=C1)Cl)Br Z1269134572 [0,2,0,0,0,0|2,0,0]=4 1208 B9R1.69 FC1=C(C=NC(=N1)Cl)Cl Z2311075548 [0,2,0,0,0,0|2,0,0]=4 1209 B9R1.69 FC1=C(N=C(N=C1)Cl)Cl Z217688316 [0,2,0,0,0,0|2,0,0]=4 1210 B9R1.69 FC1=C(N=C(N=C1)Cl)F Z1813100293 [0,2,0,0,0,0|2,0,0]=4 1211 B9R1.69 FC1=C(N=CC(=C1)Cl)F Z1255442949 [0,2,0,0,0,0|1,0,0]=3 1212 B9R1.69 FC1=CC(=C(C=C1)F)Br Z299596112 [0,2,0,0,0,0|2,0,0]=4 1213 B9R1.69 FC1=CC(=C(C=C1)I)F Z381540726 [0,2,0,0,0,0|2,0,0]=4 1214 B9R1.69 FC1=NC(=C(C=N1)Cl)F Z1198165311 [0,2,0,0,0,0|2,0,0]=4 1215 B9R1.69 N=C1N=C(NC=C1N)N Z2168496108 [0,2,0,0,0,0|2,0,0]=4 1216 B9R1.69 NC1=C(C=C(C=C1)Br)Br Z104477574 [0,2,0,0,0,0|2,0,0]=4 1217 B9R1.69 NC1=C(C=C(C=C1)Br)Cl Z104482600 [0,2,0,0,0,0|2,0,0]=4 1218 B9R1.69 NC1=C(C=C(C=C1)Br)F Z104476130 [0,2,0,0,0,0|2,0,0]=4 1219 B9R1.69 NC1=C(C=C(C=C1)Br)I Z57662459 [0,2,0,0,0,0|2,0,0]=4 1220 B9R1.69 NC1=C(C=C(C=C1)Br)N Z385438802 [0,2,0,0,0,0|2,0,0]=4 1221 B9R1.69 NC1=C(C=C(C=C1)Br)O Z381757544 [0,2,0,0,0,0|2,0,0]=4 1222 B9R1.69 NC1=C(C=C(C=C1)Cl)Cl Z57127562 [0,2,0,0,0,0|2,0,0]=4 1223 B9R1.69 NC1=C(C=C(C=C1)Cl)F Z104477618 [0,2,0,0,0,0|2,0,0]=4 1224 B9R1.69 NC1=C(C=C(C=C1)Cl)N Z104477888 [0,2,0,0,0,0|2,0,0]=4 1225 B9R1.69 NC1=C(C=C(C=C1)F)Br Z361887364 [0,2,0,0,0,0|2,0,0]=4 1226 B9R1.69 NC1=C(C=C(C=C1)F)Cl Z104495500 [0,2,0,0,0,0|2,0,0]=4 1227 B9R1.69 NC1=C(C=C(C=C1)F)F Z104476120 [0,2,0,0,0,0|2,0,0]=4 1228 B9R1.69 NC1=C(C=C(C=C1)F)N Z273611666 [0,2,0,0,0,0|2,0,0]=4 1229 B9R1.69 NC1=C(C=C(C=C1)F)O Z944939338 [0,2,0,0,0,0|2,0,0]=4 1230 B9R1.69 NC1=C(C=C(C=C1)I)Br Z1037337330 [0,2,0,0,0,0|2,0,0]=4 1231 B9R1.69 NC1=C(C=C(C=C1)I)Cl Z381786936 [0,2,0,0,0,0|2,0,0]=4 1232 B9R1.69 NC1=C(C=C(C=C1)I)N Z852343818 [0,2,0,0,0,0|2,0,0]=4 1233 B9R1.69 NC1=C(C=C(C=C1)I)O Z952016282 [0,2,0,0,0,0|2,0,0]=4 1234 B9R1.69 NC1=C(C=C(C=C1)O)Br Z1198266788 [0,2,0,0,0,0|2,0,0]=4 1235 B9R1.69 NC1=C(C=C(C=C1)O)I Z1874937257 [0,2,0,0,0,0|2,0,0]=4 1236 B9R1.69 NC1=C(C=C(C=C1)O)N Z2787258827 [0,2,0,0,0,0|2,0,0]=4 1237 B9R1.69 NC1=C(C=C(C=C1)O)O Z1741980625 [0,2,0,0,0,0|2,0,0]=4 1238 B9R1.69 NC1=C(C=C(C=N1)Br)F Z1255491677 [0,2,0,0,0,0|1,0,0]=3 1239 B9R1.69 NC1=C(C=C(C=N1)Br)O Z1198222031 [0,2,0,0,0,0|1,0,0]=3 1240 B9R1.69 NC1=C(C=C(C=N1)Cl)Br Z1250167432 [0,2,0,0,0,0|1,0,0]=3 1241 B9R1.69 NC1=C(C=C(C=N1)Cl)Cl Z104477096 [0,2,0,0,0,0|1,0,0]=3 1242 B9R1.69 NC1=C(C=C(C=N1)Cl)I Z1230090484 [0,2,0,0,0,0|1,0,0]=3 1243 B9R1.69 NC1=C(C=C(C=N1)F)Br Z1201621986 [0,2,0,0,0,0|1,0,0]=3 1244 B9R1.69 NC1=C(C=C(C=N1)F)Cl Z1198218421 [0,2,0,0,0,0|1,0,0]=3 1245 B9R1.69 NC1=C(C=C(C=N1)F)I Z1269165281 [0,2,0,0,0,0|1,0,0]=3 1246 B9R1.69 NC1=C(C=C(C=N1)O)F Z1255463636 [0,2,0,0,0,0|1,0,0]=3 1247 B9R1.69 NC1=C(C=CC(=C1)Br)Br Z278196860 [0,2,0,0,0,0|2,0,0]=4 1248 B9R1.69 NC1=C(C=CC(=C1)Br)F Z406521002 [0,2,0,0,0,0|2,0,0]=4 1249 B9R1.69 NC1=C(C=CC(=C1)Br)I Z414834736 [0,2,0,0,0,0|2,0,0]=4 1250 B9R1.69 NC1=C(C=CC(=C1)Br)O Z385458142 [0,2,0,0,0,0|2,0,0]=4 1251 B9R1.69 NC1=C(C=CC(=C1)Cl)Cl Z56951217 [0,2,0,0,0,0|2,0,0]=4 1252 B9R1.69 NC1=C(C=CC(=C1)Cl)O Z104474586 [0,2,0,0,0,0|2,0,0]=4 1253 B9R1.69 NC1=C(C=CC(=C1)Cl)S Z108565176 [0,2,0,0,0,0|2,0,0]=4 1254 B9R1.69 NC1=C(C=CC(=C1)F)Cl Z1089905956 [0,2,0,0,0,0|2,0,0]=4 1255 B9R1.69 NC1=C(C=CC(=C1)F)F Z104476212 [0,2,0,0,0,0|2,0,0]=4 1256 B9R1.69 NC1=C(C=CC(=C1)F)O Z385458128 [0,2,0,0,0,0|2,0,0]=4 1257 B9R1.69 NC1=C(C=CC(=C1)I)Br Z1037337332 [0,2,0,0,0,0|2,0,0]=4 1258 B9R1.69 NC1=C(C=CC(=C1)I)Cl Z414834738 [0,2,0,0,0,0|2,0,0]=4 1259 B9R1.69 NC1=C(C=CC(=C1)I)O Z952016182 [0,2,0,0,0,0|2,0,0]=4 1260 B9R1.69 NC1=C(C=CC(=C1)O)Br Z1198218415 [0,2,0,0,0,0|2,0,0]=4 1261 B9R1.69 NC1=C(C=CC(=C1)O)Cl Z1203578249 [0,2,0,0,0,0|2,0,0]=4 1262 B9R1.69 NC1=C(C=CC(=C1)O)F Z1201624911 [0,2,0,0,0,0|2,0,0]=4 1263 B9R1.69 NC1=C(C=CC(=N1)Br)O Z1198313435 [0,2,0,0,0,0|1,0,0]=3 1264 B9R1.69 NC1=C(C=NC(=O)N1)Br Z1737940730 [0,2,0,0,0,0|2,0,0]=4 1265 B9R1.69 NC1=C(C=NC(=O)N1)F Z1201621875 [0,2,0,0,0,0|2,0,0]=4 1266 B9R1.69 NC1=C(N=C(C=C1)Br)N Z1198277838 [0,2,0,0,0,0|1,0,0]=3 1267 B9R1.69 NC1=C(N=C(C=C1)Cl)N Z906122758 [0,2,0,0,0,0|1,0,0]=3 1268 B9R1.69 NC1=C(N=C(N=C1)S)N Z314598980 [0,2,0,0,0,0|2,0,0]=4 1269 B9R1.69 NC1=C(N=CC(=C1)Br)N Z56950512 [0,2,0,0,0,0|1,0,0]=3 1270 B9R1.69 NC1=C(N=CC(=C1)Cl)N Z273611680 [0,2,0,0,0,0|1,0,0]=3 1271 B9R1.69 NC1=C(N=CC(=C1)Cl)O Z1198173076 [0,2,0,0,0,0|1,0,0]=3 1272 B9R1.69 NC1=C(N=CC(=C1)I)O Z1486012481 [0,2,0,0,0,0|1,0,0]=3 1273 B9R1.69 NC1=CC(=C(C=C1)Br)O Z1198266787 [0,2,0,0,0,0|2,0,0]=4 1274 B9R1.69 NC1=CC(=C(C=C1)Cl)Cl Z56926514 [0,2,0,0,0,0|2,0,0]=4 1275 B9R1.69 NC1=CC(=C(C=C1)Cl)F Z382694754 [0,2,0,0,0,0|2,0,0]=4 1276 B9R1.69 NC1=CC(=C(C=C1)Cl)I Z1269165366 [0,2,0,0,0,0|2,0,0]=4 1277 B9R1.69 NC1=CC(=C(C=C1)F)Cl Z104477780 [0,2,0,0,0,0|2,0,0]=4 1278 B9R1.69 NC1=CC(=C(C=C1)F)F Z104476136 [0,2,0,0,0,0|2,0,0]=4 1279 B9R1.69 NC1=CC(=C(C=C1)F)O Z1201626992 [0,2,0,0,0,0|2,0,0]=4 1280 B9R1.69 NC1=CC(=C(C=C1)I)Br Z1037337336 [0,2,0,0,0,0|2,0,0]=4 1281 B9R1.69 NC1=CC(=C(C=C1)I)F Z1266874961 [0,2,0,0,0,0|2,0,0]=4 1282 B9R1.69 NC1=CC(=C(C=C1)N)Cl Z256708872 [0,2,0,0,0,0|2,0,0]=4 1283 B9R1.69 NC1=CC(=C(C=C1)O)Cl Z385458136 [0,2,0,0,0,0|2,0,0]=4 1284 B9R1.69 NC1=CC(=C(C=C1)O)N Z104474202 [0,2,0,0,0,0|2,0,0]=4 1285 B9R1.69 NC1=CC(=C(C=C1)S)Br Z852342850 [0,2,0,0,0,0|2,0,0]=4 1286 B9R1.69 NC1=CC(=CNC1=O)Br Z1259335894 [0,2,0,0,0,0|1,0,1]=4 1287 B9R1.69 NC1=CC(=O)C(=CN1)Br Z2177030576 [0,2,0,0,0,0|1,0,1]=4 1288 B9R1.69 NC1=CC(=O)C(=CN1)Cl Z2017843154 [0,2,0,0,0,0|1,0,1]=4 1289 B9R1.69 NC1=CC=C(C(=O)N1)Br Z1837073453 [0,2,0,0,0,0|1,0,1]=4 1290 B9R1.69 NC1=CN=C(C=C1Br)N Z2310147706 [0,2,0,0,0,0|1,0,0]=3 1291 B9R1.69 NC1=CNC(=O)N=C1N Z3217362668 [0,2,0,0,0,0|2,0,0]=4 1292 B9R1.69 NC1=NC(=C(C=C1)I)N Z1269132396 [0,2,0,0,0,0|1,0,0]=3 1293 B9R1.69 NC1=NC(=C(C=N1)Br)N Z1255491673 [0,2,0,0,0,0|2,0,0]=4 1294 B9R1.69 NC1=NC(=C(C=N1)Cl)N Z1198237690 [0,2,0,0,0,0|2,0,0]=4 1295 B9R1.69 NC1=NC(=C(C=N1)F)N Z1255445671 [0,2,0,0,0,0|2,0,0]=4 1296 B9R1.69 NC1=NC(=O)C(=CN1)Cl Z2235384731 [0,2,0,0,0,0|2,0,0]=4 1297 B9R1.69 NC1=NC=C(C(=C1)Br)Cl Z1269241430 [0,2,0,0,0,0|1,0,0]=3 1298 B9R1.69 NC1=NC=C(C(=C1)Cl)Cl Z1201624122 [0,2,0,0,0,0|1,0,0]=3 1299 B9R1.69 NC1=NC=C(C(=C1)Cl)I Z1269198371 [0,2,0,0,0,0|1,0,0]=3 1300 B9R1.69 NC1=NC=C(C(=C1)F)Br Z1255367303 [0,2,0,0,0,0|1,0,0]=3 1301 B9R1.69 NC1=NC=C(C(=O)N1)I Z1272073698 [0,2,0,0,0,0|2,0,0]=4 1302 B9R1.69 O=C1C=C(C(=CN1)Br)O Z1258976635 [0,2,0,0,0,0|1,0,1]=4 1303 B9R1.69 O=C1C=C(C(=CN1)Cl)O Z1201624655 [0,2,0,0,0,0|1,0,1]=4 1304 B9R1.69 O=C1NC=C(C=C1Br)I Z1269234992 [0,2,0,0,0,0|1,0,1]=4 1305 B9R1.69 O=C1NC=C(C=C1O)Br Z2418194162 [0,2,0,0,0,0|1,0,1]=4 1306 B9R1.69 OC1=C(C=C(C=C1)Br)Br Z57203203 [0,2,0,0,0,0|2,0,0]=4 1307 B9R1.69 OC1=C(C=C(C=C1)Br)Cl Z57233584 [0,2,0,0,0,0|2,0,0]=4 1308 B9R1.69 OC1=C(C=C(C=C1)Cl)F Z147646796 [0,2,0,0,0,0|2,0,0]=4 1309 B9R1.69 OC1=C(C=C(C=C1)F)Cl Z104495502 [0,2,0,0,0,0|2,0,0]=4 1310 B9R1.69 OC1=C(C=C(C=C1)F)F Z147646792 [0,2,0,0,0,0|2,0,0]=4 1311 B9R1.69 OC1=C(C=C(C=C1)F)O Z1201620941 [0,2,0,0,0,0|2,0,0]=4 1312 B9R1.69 OC1=C(C=C(C=C1)I)I Z1269227074 [0,2,0,0,0,0|2,0,0]=4 1313 B9R1.69 OC1=C(C=C(C=N1)Br)Cl Z1269176244 [0,2,0,0,0,0|1,0,0]=3 1314 B9R1.69 OC1=C(C=C(C=N1)Cl)Br Z1269191046 [0,2,0,0,0,0|1,0,0]=3 1315 B9R1.69 OC1=C(C=C(C=N1)Cl)I Z1269133390 [0,2,0,0,0,0|1,0,0]=3 1316 B9R1.69 OC1=C(C=CC(=C1)Br)Cl Z381430752 [0,2,0,0,0,0|2,0,0]=4 1317 B9R1.69 OC1=C(C=CC(=C1)Cl)F Z421826226 [0,2,0,0,0,0|2,0,0]=4 1318 B9R1.69 OC1=C(C=CC(=C1)F)Br Z1203161754 [0,2,0,0,0,0|2,0,0]=4 1319 B9R1.69 OC1=C(C=CC(=C1)F)F Z401432098 [0,2,0,0,0,0|2,0,0]=4 1320 B9R1.69 OC1=C(N=C(C=C1)Cl)I Z1269175731 [0,2,0,0,0,0|1,0,0]=3 1321 B9R1.69 OC1=C(N=CC(=C1)Cl)O Z203045260 [0,2,0,0,0,0|1,0,0]=3 1322 B9R1.69 OC1=CC(=C(C=C1)Br)F Z1154597041 [0,2,0,0,0,0|2,0,0]=4 1323 B9R1.69 OC1=CC(=C(C=C1)Cl)Cl Z104477762 [0,2,0,0,0,0|2,0,0]=4 1324 B9R1.69 OC1=CC(=C(C=C1)F)Cl Z104477690 [0,2,0,0,0,0|2,0,0]=4 1325 B9R1.69 OC1=CC(=C(C=C1)F)F Z56347116 [0,2,0,0,0,0|2,0,0]=4 1326 B9R1.69 OC1=CC(=C(C=C1)O)O Z1255438414 [0,2,0,0,0,0|2,0,0]=4 1327 B9R1.69 OC1=NN=C(C(=C1)Br)O Z1198655184 [0,2,0,0,0,0|2,0,0]=4 1328 B9R1.69 SC1=C(C=CC(=C1)Cl)Cl Z56941088 [0,2,0,0,0,0|2,0,0]=4 1329 B9R1.3 CC1=C(C(=CC=C1)Br)C Z165205526 [0,2,0,0,0,0|1,0,0]=3 1330 B9R1.3 CC1=C(C(=CC=C1)N)Br Z1255379702 [0,2,0,0,0,0|1,0,0]=3 1331 B9R1.3 CC1=C(C(=CC=C1)N)C Z104472546 [0,2,0,0,0,0|1,0,0]=3 1332 B9R1.3 CC1=C(C(=CC=C1)N)Cl Z1198316539 [0,2,0,0,0,0|1,0,0]=3 1333 B9R1.3 CC1=C(C(=CC=C1)N)N Z104493206 [0,2,0,0,0,0|1,0,0]=3 1334 B9R1.3 CC1=C(C(=CC=C1)O)Br Z1198267200 [0,2,0,0,0,0|1,0,0]=3 1335 B9R1.3 CC1=C(C(=CC=C1)O)Cl Z1198147985 [0,2,0,0,0,0|1,0,0]=3 1336 B9R1.3 CC1=C(C(=CC=C1)O)I Z1269223622 [0,2,0,0,0,0|1,0,0]=3 1337 B9R1.3 CC1=C(C(=CC=C1)O)N Z729250490 [0,2,0,0,0,0|1,0,0]=3 1338 B9R1.3 CC1=C(C(=CC=C1)O)O Z56347229 [0,2,0,0,0,0|1,0,0]=3 1339 B9R1.3 CC1=C(C(=CC=N1)Cl)Cl Z1198234260 [0,2,0,0,0,0|1,0,0]=3 1340 B9R1.3 CC1=C(C(=CC=N1)N)Br Z1198314047 [0,2,0,0,0,0|1,0,0]=3 1341 B9R1.3 CC1=C(C(=CC=N1)N)Cl Z1198221360 [0,2,0,0,0,0|1,0,0]=3 1342 B9R1.3 CC1=C(C(=CC=N1)O)Cl Z1255417996 [0,2,0,0,0,0|1,0,0]=3 1343 B9R1.3 CC1=C(C(=CN=C1)Br)C Z1255428261 [0,2,0,0,0,0|0,0,0]=2 1344 B9R1.3 CC1=C(C(=CN=C1)Br)N Z1198173286 [0,2,0,0,0,0|0,0,0]=2 1345 B9R1.3 CC1=C(C(=NC=C1)N)Br Z1198175808 [0,2,0,0,0,0|1,0,0]=3 1346 B9R1.3 CC1=C(C(=NC=C1)N)C Z3241253461 [0,2,0,0,0,0|0,0,0]=2 1347 B9R1.3 CC1=C(C(=NC=C1)N)N Z1143235798 [0,2,0,0,0,0|1,0,0]=3 1348 B9R1.3 CC1=C(C(=NC=C1)O)Br Z1198234337 [0,2,0,0,0,0|1,0,0]=3 1349 B9R1.3 CC1=C(C(=NC=N1)Br)F Z1255505111 [0,2,0,0,0,0|2,0,0]=4 1350 B9R1.3 CC1=C(C(=NC=N1)Cl)Br Z1269217093 [0,2,0,0,0,0|2,0,0]=4 1351 B9R1.3 CC1=C(C(=NC=N1)Cl)C Z800200816 [0,2,0,0,0,0|1,0,0]=3 1352 B9R1.3 CC1=C(C(=NC=N1)Cl)F Z988984134 [0,2,0,0,0,0|2,0,0]=4 1353 B9R1.3 CC1=C(C(=NC=N1)N)Br Z1198154319 [0,2,0,0,0,0|2,0,0]=4 1354 B9R1.3 CC1=C(C(=NC=N1)N)C Z904980686 [0,2,0,0,0,0|1,0,0]=3 1355 B9R1.3 CC1=C(C(=NC=N1)O)C Z1642061386 [0,2,0,0,0,0|1,0,0]=3 1356 B9R1.3 CC1=C(C(=NC=N1)O)F Z3234879708 [0,2,0,0,0,0|2,0,0]=4 1357 B9R1.3 CC1=C(C(=NN=C1)Cl)C Z1813117531 [0,2,0,0,0,0|1,0,0]=3 1358 B9R1.3 CC1=C(C(=O)C=CN1)C Z1203830064 [0,2,0,0,0,0|0,0,1]=3 1359 B9R1.3 CC1=C(C(=O)C=CO1)O Z1255382969 [0,2,0,0,0,0|2,0,0]=4 1360 B9R1.3 CC1=C(C(=S)C=CO1)O Z1198156366 [0,2,0,0,0,0|2,0,0]=4 1361 B9R1.3 CC1=C(C=CC=C1Cl)Br Z1269115561 [0,2,0,0,0,0|1,0,0]=3 1362 B9R1.3 CC1=C(C=CC=C1Cl)Cl Z317043666 [0,2,0,0,0,0|1,0,0]=3 1363 B9R1.3 CC1=C(C=CC=C1Cl)I Z381540782 [0,2,0,0,0,0|1,0,0]=3 1364 B9R1.3 CC1=C(C=CC=C1N)Br Z1037334720 [0,2,0,0,0,0|1,0,0]=3 1365 B9R1.3 CC1=C(C=CC=C1N)F Z838909452 [0,2,0,0,0,0|1,0,0]=3 1366 B9R1.3 CC1=C(C=CC=C1O)F Z838919472 [0,2,0,0,0,0|1,0,0]=3 1367 B9R1.3 CC1=C(C=CN=C1N)O Z3875516970 [0,2,0,0,0,0|0,0,0]=2 1368 B9R1.3 CC1=C(C=NC=C1N)Br Z2858793424 [0,2,0,0,0,0|1,0,0]=3 1369 B9R1.3 CC1=C(C=NC=C1N)Cl Z1198173364 [0,2,0,0,0,0|1,0,0]=3 1370 B9R1.3 CC1=C(N=CN=C1Cl)Cl Z1140399216 [0,2,0,0,0,0|1,0,0]=3 1371 B9R1.3 CC1=C(N=CN=C1F)F Z1255361469 [0,2,0,0,0,0|1,0,0]=3 1372 B9R1.3 CC1=C(N=CN=C1N)N Z1203580747 [0,2,0,0,0,0|1,0,0]=3 1373 B9R1.3 CC1=C(NC=NC1=O)N Z2216303046 [0,2,0,0,0,0|1,0,0]=3 1374 B9R1.3 CC1=CC=CC(=C1N)C Z57127391 [0,2,0,0,0,0|1,0,0]=3 1375 B9R1.3 CC1=CC=CC(=C1O)C Z104473832 [0,2,0,0,0,0|1,0,0]=3 1376 B9R1.3 CC1=CN=CC(=C1N)C Z1741978315 [0,2,0,0,0,0|0,0,0]=2 1377 B9R1.3 CC1=CNC=C(C1=O)Br Z1262586634 [0,2,0,0,0,0|0,0,1]=3 1378 B9R1.3 CC1=NC=CC(=C1N)C Z1203578937 [0,2,0,0,0,0|1,0,0]=3 1379 B9R1.3 CC1=NC=NC(=C1O)C Z1255461596 [0,2,0,0,0,0|2,0,0]=4 1380 B9R1.3 CN1C(=O)C=CN=C1N Z990948114 [0,2,0,0,0,0|1,0,0]=3 1381 B9R1.3 CN1C(=O)C=CNC1=O Z2588063529 [0,2,0,0,0,0|1,0,1]=4 1382 B9R1.3 CN1C=CC=C(C1=O)Br Z1198320616 [0,2,0,0,0,0|1,0,1]=4 1383 B9R1.3 CN1C=CC=C(C1=O)O Z1201625929 [0,2,0,0,0,0|1,0,1]=4 1384 B9R1.3 CN1C=CN=C(C1=O)N Z1037587554 [0,2,0,0,0,0|2,0,0]=4 1385 B9R1.3 CN1C=NC=C(C1=O)N Z2492774469 [0,2,0,0,0,0|1,0,0]=3 1386 B9R1.3 ClC1=C(C(=CC=C1)I)Cl Z381540840 [0,2,0,0,0,0|2,0,0]=4 1387 B9R1.3 ClC1=C(C(=CN=C1)Br)Cl Z1269216126 [0,2,0,0,0,0|1,0,0]=3 1388 B9R1.3 ClC1=C(C=CC=C1Br)I Z1269134811 [0,2,0,0,0,0|2,0,0]=4 1389 B9R1.3 ClC1=C(N=CN=C1Br)Br Z3273140637 [0,2,0,0,0,0|2,0,0]=4 1390 B9R1.3 ClC1=CC=CC(=C1Br)Cl Z1269197746 [0,2,0,0,0,0|2,0,0]=4 1391 B9R1.3 ClC1=NC=NC(=C1Br)Cl Z1269195590 [0,2,0,0,0,0|2,0,0]=4 1392 B9R1.3 ClC1=NN=CC(=C1Cl)Cl Z1245735161 [0,2,0,0,0,0|2,0,0]=4 1393 B9R1.3 FC1=C(C(=CC=C1)Br)Cl Z1269134763 [0,2,0,0,0,0|2,0,0]=4 1394 B9R1.3 FC1=C(C(=CC=C1)Br)F Z1203161750 [0,2,0,0,0,0|2,0,0]=4 1395 B9R1.3 FC1=C(C(=NC=N1)Cl)Br Z2680367276 [0,2,0,0,0,0|2,0,0]=4 1396 B9R1.3 FC1=C(C=CC=C1Br)I Z1269161863 [0,2,0,0,0,0|2,0,0]=4 1397 B9R1.3 FC1=C(N=CN=C1Cl)Cl Z1198175235 [0,2,0,0,0,0|2,0,0]=4 1398 B9R1.3 FC1=CC=CC(=C1I)F Z381540834 [0,2,0,0,0,0|2,0,0]=4 1399 B9R1.3 NC1=C(C(=CC=C1)Br)Cl Z1269145063 [0,2,0,0,0,0|2,0,0]=4 1400 B9R1.3 NC1=C(C(=CC=C1)Br)I Z2471262222 [0,2,0,0,0,0|2,0,0]=4 1401 B9R1.3 NC1=C(C(=CC=C1)Cl)Cl Z57127893 [0,2,0,0,0,0|2,0,0]=4 1402 B9R1.3 NC1=C(C(=CC=C1)Cl)N Z228582776 [0,2,0,0,0,0|2,0,0]=4 1403 B9R1.3 NC1=C(C(=CC=C1)Cl)O Z274763124 [0,2,0,0,0,0|2,0,0]=4 1404 B9R1.3 NC1=C(C(=CC=C1)Cl)S Z1217910557 [0,2,0,0,0,0|2,0,0]=4 1405 B9R1.3 NC1=C(C(=CC=C1)F)Br Z1741968073 [0,2,0,0,0,0|2,0,0]=4 1406 B9R1.3 NC1=C(C(=CC=C1)F)Cl Z1201622187 [0,2,0,0,0,0|2,0,0]=4 1407 B9R1.3 NC1=C(C(=CC=C1)F)F Z755885564 [0,2,0,0,0,0|2,0,0]=4 1408 B9R1.3 NC1=C(C(=CC=C1)F)N Z451390566 [0,2,0,0,0,0|2,0,0]=4 1409 B9R1.3 NC1=C(C(=CC=C1)F)O Z1203578717 [0,2,0,0,0,0|2,0,0]=4 1410 B9R1.3 NC1=C(C(=CC=C1)I)F Z3766096426 [0,2,0,0,0,0|2,0,0]=4 1411 B9R1.3 NC1=C(C(=CC=C1)O)Br Z1255432102 [0,2,0,0,0,0|2,0,0]=4 1412 B9R1.3 NC1=C(C(=CC=C1)O)F Z1255393351 [0,2,0,0,0,0|2,0,0]=4 1413 B9R1.3 NC1=C(C(=CC=N1)F)I Z2582143713 [0,2,0,0,0,0|1,0,0]=3 1414 B9R1.3 NC1=C(C(=CN=C1)Br)Br Z1558574396 [0,2,0,0,0,0|1,0,0]=3 1415 B9R1.3 NC1=C(C(=CN=C1)Br)Cl Z1269220049 [0,2,0,0,0,0|1,0,0]=3 1416 B9R1.3 NC1=C(C(=CN=C1)Br)O Z1201624800 [0,2,0,0,0,0|1,0,0]=3 1417 B9R1.3 NC1=C(C(=CN=C1)Cl)Br Z2027914941 [0,2,0,0,0,0|1,0,0]=3 1418 B9R1.3 NC1=C(C(=CN=C1)Cl)Cl Z1255458418 [0,2,0,0,0,0|1,0,0]=3 1419 B9R1.3 NC1=C(C(=CN=C1)I)O Z2768165482 [0,2,0,0,0,0|1,0,0]=3 1420 B9R1.3 NC1=C(C(=NC=C1)O)N Z1198272393 [0,2,0,0,0,0|1,0,0]=3 1421 B9R1.3 NC1=C(C(=NC=N1)O)Br Z540727052 [0,2,0,0,0,0|2,0,0]=4 1422 B9R1.3 NC1=C(C(=NC=N1)O)N Z1198147238 [0,2,0,0,0,0|2,0,0]=4 1423 B9R1.3 NC1=C(C(=O)N=CN1)Cl Z1945706336 [0,2,0,0,0,0|2,0,0]=4 1424 B9R1.3 NC1=C(C(=O)N=CN1)I Z2218556128 [0,2,0,0,0,0|2,0,0]=4 1425 B9R1.3 NC1=C(C(=O)NN=C1)Br Z1262649674 [0,2,0,0,0,0|2,0,0]=4 1426 B9R1.3 NC1=C(C(=O)NN=C1)Cl Z1198157209 [0,2,0,0,0,0|2,0,0]=4 1427 B9R1.3 NC1=C(C=CC=C1Br)I Z1269155130 [0,2,0,0,0,0|2,0,0]=4 1428 B9R1.3 NC1=C(C=CC=C1Cl)Br Z3214213373 [0,2,0,0,0,0|2,0,0]=4 1429 B9R1.3 NC1=C(C=CC=C1F)F Z104476070 [0,2,0,0,0,0|2,0,0]=4 1430 B9R1.3 NC1=C(C=CC=C1O)F Z2503749237 [0,2,0,0,0,0|2,0,0]=4 1431 B9R1.3 NC1=C(C=CC=C1O)O Z1198149142 [0,2,0,0,0,0|2,0,0]=4 1432 B9R1.3 NC1=C(C=NC=C1Cl)Cl Z56914860 [0,2,0,0,0,0|1,0,0]=3 1433 B9R1.3 NC1=C(C=NC=C1Cl)I Z1342183825 [0,2,0,0,0,0|1,0,0]=3 1434 B9R1.3 NC1=C(C=NC=C1F)Cl Z1255467513 [0,2,0,0,0,0|1,0,0]=3 1435 B9R1.3 NC1=C(C=NC=C1F)F Z5373122875 [0,2,0,0,0,0|1,0,0]=3 1436 B9R1.3 NC1=C(N=CN=C1S)S Z1251357257 [0,2,0,0,0,0|2,0,0]=4 1437 B9R1.3 NC1=CC=CC(=C1Cl)N Z1203578785 [0,2,0,0,0,0|2,0,0]=4 1438 B9R1.3 NC1=CNC=C(C1=S)Br Z1901071787 [0,2,0,0,0,0|1,0,1]=4 1439 B9R1.3 NC1=NC=NC(=C1I)N Z1269152433 [0,2,0,0,0,0|2,0,0]=4 1440 B9R1.3 NC1=NC=NC(=C1N)N Z1198147874 [0,2,0,0,0,0|2,0,0]=4 1441 B9R1.3 O=C1NC=NC(=C1Cl)Cl Z1695922842 [0,2,0,0,0,0|2,0,0]=4 1442 B9R1.3 O=C1NN=CC(=C1Br)Br Z235345327 [0,2,0,0,0,0|2,0,0]=4 1443 B9R1.3 O=C1NN=CC(=C1Cl)Cl Z56851261 [0,2,0,0,0,0|2,0,0]=4 1444 B9R1.3 OC1=C(C(=CC=C1)Br)F Z1201625280 [0,2,0,0,0,0|2,0,0]=4 1445 B9R1.3 OC1=C(C(=CC=C1)Br)O Z1255450532 [0,2,0,0,0,0|2,0,0]=4 1446 B9R1.3 OC1=C(C(=CC=C1)Cl)Cl Z104477856 [0,2,0,0,0,0|2,0,0]=4 1447 B9R1.3 OC1=C(C(=CC=C1)Cl)O Z1255356375 [0,2,0,0,0,0|2,0,0]=4 1448 B9R1.3 OC1=C(C(=CC=C1)F)F Z756095632 [0,2,0,0,0,0|2,0,0]=4 1449 B9R1.3 OC1=C(C(=CC=C1)F)I Z1269212770 [0,2,0,0,0,0|2,0,0]=4 1450 B9R1.3 OC1=C(C(=CC=N1)Br)Cl Z1269109671 [0,2,0,0,0,0|1,0,0]=3 1451 B9R1.3 OC1=C(C(=NC=N1)Cl)I Z1380033225 [0,2,0,0,0,0|2,0,0]=4 1452 B9R1.3 OC1=C(C=CC=C1Br)Br Z285522740 [0,2,0,0,0,0|2,0,0]=4 1453 B9R1.3 OC1=C(C=CC=C1Cl)Br Z1269200416 [0,2,0,0,0,0|2,0,0]=4 1454 B9R1.3 OC1=C(C=CC=C1Cl)I Z1269132398 [0,2,0,0,0,0|2,0,0]=4 1455 B9R1.3 OC1=C(C=CC=C1F)F Z147646794 [0,2,0,0,0,0|2,0,0]=4 1456 B9R1.3 OC1=C(C=NC=C1Br)I Z1862026276 [0,2,0,0,0,0|1,0,0]=3 1457 B9R1.3 OC1=CC=CC(=C1F)O Z1198233471 [0,2,0,0,0,0|2,0,0]=4 1458 B9R1.3 OC1=CC=CC(=C1O)O Z57127553 [0,2,0,0,0,0|2,0,0]=4 1459 B9R1.3 SC1=C(C=CC=C1Cl)Cl Z56347203 [0,2,0,0,0,0|2,0,0]=4 1460 B9R1.34 CC1=CC(=CC(=C1)F)Br Z600393520 [0,2,0,0,0,0|1,0,0]=3 1461 B9R1.34 CC1=CC(=CC(=C1)N)C Z104477214 [0,2,0,0,0,0|1,0,0]=3 1462 B9R1.34 CC1=CC(=CC(=C1)N)I Z1269159888 [0,2,0,0,0,0|1,0,0]=3 1463 B9R1.34 CC1=CC(=CC(=C1)N)N Z2731710836 [0,2,0,0,0,0|1,0,0]=3 1464 B9R1.34 CC1=CC(=CC(=C1)N)O Z1198150375 [0,2,0,0,0,0|1,0,0]=3 1465 B9R1.34 CC1=CC(=CC(=C1)O)C Z104477220 [0,2,0,0,0,0|1,0,0]=3 1466 B9R1.34 CC1=CC(=CC(=C1)O)Cl Z1198176469 [0,2,0,0,0,0|1,0,0]=3 1467 B9R1.34 CC1=CC(=CC(=C1)O)O Z1079442080 [0,2,0,0,0,0|1,0,0]=3 1468 B9R1.34 CC1=CC(=CC(=N1)C)N Z1201619217 [0,2,0,0,0,0|2,0,0]=4 1469 B9R1.34 CC1=CC(=CC(=O)O1)O Z104477314 [0,2,0,0,0,0|2,0,0]=4 1470 B9R1.34 CC1=CC(=NC(=C1)C)C Z104472822 [0,2,0,0,0,0|2,0,0]=4 1471 B9R1.34 CC1=CC(=NC(=C1)C)N Z1192367241 [0,2,0,0,0,0|2,0,0]=4 1472 B9R1.34 CC1=CC(=O)C=C(N1)C Z56754506 [0,2,0,0,0,0|2,0,0]=4 1473 B9R1.34 CC1=CC(=O)C=C(O1)C Z104477080 [0,2,0,0,0,0|2,0,0]=4 1474 B9R1.34 CC1=CC(=O)NC(=C1)N Z104343026 [0,2,0,0,0,0|2,0,0]=4 1475 B9R1.34 CC1=CC(=S)C=C(O1)C Z1198151368 [0,2,0,0,0,0|2,0,0]=4 1476 B9R1.34 ClC1=CC(=CC(=C1)Br)Cl Z425865630 [0,2,0,0,0,0|2,0,0]=4 1477 B9R1.34 ClC1=CC(=CC(=C1)Br)I Z1269163949 [0,2,0,0,0,0|2,0,0]=4 1478 B9R1.34 ClC1=CC(=CC(=C1)Cl)Cl Z1255449966 [0,2,0,0,0,0|2,0,0]=4 1479 B9R1.34 ClC1=CC(=CC(=C1)I)Cl Z401461928 [0,2,0,0,0,0|2,0,0]=4 1480 B9R1.34 IC1=CC(=CC(=C1)I)I Z56755984 [0,2,0,0,0,0|2,0,0]=4 1481 B9R1.34 NC1=CC(=CC(=C1)Br)I Z1269180683 [0,2,0,0,0,0|2,0,0]=4 1482 B9R1.34 NC1=CC(=CC(=C1)Cl)Cl Z104474382 [0,2,0,0,0,0|2,0,0]=4 1483 B9R1.34 NC1=CC(=CC(=C1)F)Br Z1276751391 [0,2,0,0,0,0|2,0,0]=4 1484 B9R1.34 NC1=CC(=CC(=C1)F)Cl Z1203579155 [0,2,0,0,0,0|2,0,0]=4 1485 B9R1.34 NC1=CC(=CC(=C1)F)F Z166631028 [0,2,0,0,0,0|2,0,0]=4 1486 B9R1.34 NC1=CC(=CC(=C1)I)I Z2177030818 [0,2,0,0,0,0|2,0,0]=4 1487 B9R1.34 NC1=CC(=CC(=C1)I)N Z1269210269 [0,2,0,0,0,0|2,0,0]=4 1488 B9R1.34 NC1=CC(=CC(=C1)O)Br Z1255437489 [0,2,0,0,0,0|2,0,0]=4 1489 B9R1.34 NC1=CC(=CC(=C1)O)F Z1255384355 [0,2,0,0,0,0|2,0,0]=4 1490 B9R1.34 NC1=CC(=CC(=C1)O)O Z1820078238 [0,2,0,0,0,0|2,0,0]=4 1491 B9R1.34 OC1=CC(=CC(=C1)Cl)Cl Z56347208 [0,2,0,0,0,0|2,0,0]=4 1492 B9R1.34 OC1=CC(=CC(=C1)Cl)I Z1269197117 [0,2,0,0,0,0|2,0,0]=4 1493 B9R1.34 OC1=CC(=CC(=C1)F)F Z384970618 [0,2,0,0,0,0|2,0,0]=4 1494 B9R1.34 OC1=CC(=CC(=C1)F)O Z1198179531 [0,2,0,0,0,0|2,0,0]=4 1495 B9R1.34 OC1=CC(=CC(=C1)O)O Z104474594 [0,2,0,0,0,0|2,0,0]=4 1496 B9R1.34 [O-][N+]1=CC(=CC(=C1)Cl)Cl Z1255488210 [0,2,0,0,0,0|1,0,1]=4 1497 B5R1.1 C1=CNC=C1 Z104479036 [1,0,0,0,1,0|0,0,1]=3 1498 B5R1.1 C1=CNC=N1 Z104472692 [1,0,0,0,1,0|1,0,0]=3 1499 B5R1.1 C1=CNN=C1 Z104507728 [1,0,0,0,1,0|1,0,0]=3 1500 B5R1.1 C1=CNN=N1 Z237528494 [1,0,0,0,1,0|2,0,0]=4 1501 B5R1.1 C1=NN=CN1 Z104479156 [1,0,0,0,1,0|2,0,0]=4 1502 B5R1.1 C1=NN=CS1 Z1198156558 [1,0,0,0,1,0|2,0,0]=4