0 B8R1.4 BrC1=NC=CC(N)=N1 PI-46732 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.4 Brc1cc[nH]c(=O)c1 PI-38916 [0,0,0,0,0,0|2,0,1]=3 2 B8R1.4 Brc1cccc(I)c1 PI-21524 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.4 Brc1cccc(I)n1 PI-36513 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.4 Brc1cccc(c1)Br PI-11676 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.4 Brc1cccc(n1)Br PI-31381 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.4 Brc1ccnc(c1)C PI-32240 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.4 Brc1ccnc(c1)Cl PI-31296 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.4 Brc1ccnc(c1)N PI-35022 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.4 Brc1cncc(Br)c1 PI-10080 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.4 Brc1ncnc(c1)Br PI-38773 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.4 C1=C(C=NC=C1Br)Cl PI-34454 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.4 C1=C(C=NC=C1Br)F PI-10088 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.4 C1=C(C=NC=C1Br)N PI-10515 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.4 C1=C(C=NC=C1Cl)Cl PI-32420 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.4 C1=C(C=NC=C1Cl)F PI-34439 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.4 C1=C(C=NC=C1Cl)O PI-40461 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.4 C1=C(C=NN=C1N)Br PI-44595 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.4 C1=C(C=NN=C1N)Br PI-44596 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.4 C1=C(N=C(C=N1)Cl)N PI-30484 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.4 C1=C(N=CN=C1N)N PI-21325 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.4 C1=C(N=CNC1=O)Cl PI-16343 [0,0,0,0,0,0|3,0,1]=4 22 B8R1.4 C1=C(N=CNC1=O)N PI-21312 [0,0,0,0,0,0|3,0,1]=4 23 B8R1.4 C1=C(N=CNC1=O)O PI-15320 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.4 C1=C(NC(=S)N=C1)N PI-21307 [0,0,0,0,0,0|3,1,0]=4 25 B8R1.4 C1=CC(=CC(=C1)Br)F PI-12279 [0,0,0,0,0,0|2,0,0]=2 26 B8R1.4 C1=CC(=CC(=C1)Br)S PI-15584 [0,0,0,0,0,0|1,1,0]=2 27 B8R1.4 C1=CC(=CC(=C1)F)O PI-16947 [0,0,0,0,0,0|1,0,0]=1 28 B8R1.4 C1=CC(=CC(=C1)I)F PI-12350 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.4 C1=CC(=CC(=C1)I)N PI-41422 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.4 C1=CC(=C[N+](=C1)[O-])Br PI-42571 [0,0,0,0,0,0|2,0,1]=3 31 B8R1.4 C1=CC(=C[N+](=C1)[O-])Cl PI-42572 [0,0,0,0,0,0|2,0,1]=3 32 B8R1.4 C1=CC(=C[N+](=C1)[O-])O PI-13309 [0,0,0,0,0,0|2,0,0]=2 33 B8R1.4 C1=CC(=NC(=C1)Br)F PI-33061 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.4 C1=CC(=NC(=C1)Br)N PI-14243 [0,0,0,0,0,0|3,0,0]=3 35 B8R1.4 C1=CC(=NC(=C1)Cl)F PI-34440 [0,0,0,0,0,0|3,0,0]=3 36 B8R1.4 C1=CC(=O)NC(=C1)N PI-28596 [0,0,0,0,0,0|2,0,1]=3 37 B8R1.4 C1=CC(=O)NC(=C1)O PI-11767 [0,0,0,0,0,0|2,0,0]=2 38 B8R1.4 C1=CN=C(C=C1Br)F PI-24079 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.4 C1=CN=C(C=C1F)F PI-40869 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.4 C1=CN=C(C=C1I)Cl PI-11387 [0,0,0,0,0,0|3,0,0]=3 41 B8R1.4 C1=CN=C(N=C1Br)Br PI-50057 [0,0,0,0,0,0|4,0,0]=4 42 B8R1.4 C1=CN=C(N=C1Cl)Br PI-39637 [0,0,0,0,0,0|4,0,0]=4 43 B8R1.4 C1=CN=C(N=C1N)Cl PI-10283 [0,0,0,0,0,0|4,0,0]=4 44 B8R1.4 C1=CN=C(N=C1N)F PI-45161 [0,0,0,0,0,0|4,0,0]=4 45 B8R1.4 C1=CN=C(N=C1N)N PI-11759 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.4 C1=CN=C(NC1=O)N PI-12796 [0,0,0,0,0,0|3,0,1]=4 47 B8R1.4 C1=CNC(=CC1=O)Br PI-35008 [0,0,0,0,0,0|2,0,1]=3 48 B8R1.4 C1=CNC(=CC1=O)Cl PI-11015 [0,0,0,0,0,0|2,0,1]=3 49 B8R1.4 C1=CNC(=O)C=C1N PI-34824 [0,0,0,0,0,0|2,0,1]=3 50 B8R1.4 C1=CNC(=O)C=C1O PI-10171 [0,0,0,0,0,0|2,0,0]=2 51 B8R1.4 C1=CNC(=S)NC1=O PI-48541 [0,0,0,0,0,0|3,0,1]=4 52 B8R1.4 CC1=CC(=CC=C1)I PI-10981 [0,0,0,0,0,0|1,0,0]=1 53 B8R1.4 CC1=CC(=CN=C1)Br PI-27499 [0,0,0,0,0,0|2,0,0]=2 54 B8R1.4 CC1=CC(=CN=C1)F PI-16772 [0,0,0,0,0,0|2,0,0]=2 55 B8R1.4 CC1=CC(=NC=C1)Br PI-10385 [0,0,0,0,0,0|2,0,0]=2 56 B8R1.4 CC1=CC(=NC=C1)Cl PI-16626 [0,0,0,0,0,0|2,0,0]=2 57 B8R1.4 CC1=CC(=NC=N1)Br PI-45128 [0,0,0,0,0,0|3,0,0]=3 58 B8R1.4 CC1=CC(=O)NC=N1 PI-32627 [0,0,0,0,0,0|2,0,1]=3 59 B8R1.4 CC1=CC(=O)NN=C1 PI-34651 [0,0,0,0,0,0|2,0,1]=3 60 B8R1.4 CC1=CC=CC(=O)N1 PI-16688 [0,0,0,0,0,0|1,0,1]=2 61 B8R1.4 CC1=CN=CC(=N1)C PI-11052 [0,0,0,0,0,0|3,0,0]=3 62 B8R1.4 CC1=C[N+](=CC=C1)[O-] PI-33810 [0,0,0,0,0,0|1,0,1]=2 63 B8R1.4 CC1=NC(=CC=C1)Br PI-23524 [0,0,0,0,0,0|2,0,0]=2 64 B8R1.4 CC1=NC(=NC=C1)Br PI-21314 [0,0,0,0,0,0|3,0,0]=3 65 B8R1.4 CC1=NC=CC(=C1)N PI-13314 [0,0,0,0,0,0|2,0,0]=2 66 B8R1.4 Cc1cc[nH]c(=O)n1 PI-21340 [0,0,0,0,0,0|2,0,1]=3 67 B8R1.4 Cc1cccc(N)n1 PI-32836 [0,0,0,0,0,0|2,0,0]=2 68 B8R1.4 Cc1cccc(n1)Cl PI-28225 [0,0,0,0,0,0|2,0,0]=2 69 B8R1.4 Cc1cccc(n1)F PI-16770 [0,0,0,0,0,0|2,0,0]=2 70 B8R1.4 Cc1ccnc(Cl)n1 PI-32949 [0,0,0,0,0,0|3,0,0]=3 71 B8R1.4 Cc1ccnc(N)c1 PI-32462 [0,0,0,0,0,0|2,0,0]=2 72 B8R1.4 Cc1ccnc(c1)F PI-23598 [0,0,0,0,0,0|2,0,0]=2 73 B8R1.4 Cc1ccnc(n1)N PI-21305 [0,0,0,0,0,0|3,0,0]=3 74 B8R1.4 Cc1ccnc(n1)S PI-21344 [0,0,0,0,0,0|2,1,0]=3 75 B8R1.4 Cc1cncc(Br)n1 PI-32830 [0,0,0,0,0,0|3,0,0]=3 76 B8R1.4 Clc1cccc(c1)I PI-39251 [0,0,0,0,0,0|2,0,0]=2 77 B8R1.4 Clc1ccnc(Cl)c1 PI-16701 [0,0,0,0,0,0|3,0,0]=3 78 B8R1.4 Clc1ccnc(Cl)n1 PI-28484 [0,0,0,0,0,0|4,0,0]=4 79 B8R1.4 Clc1ccnc(c1)N PI-11783 [0,0,0,0,0,0|3,0,0]=3 80 B8R1.4 Clc1ccnc(n1)C PI-38934 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.4 Clc1ccnc(n1)N PI-27559 [0,0,0,0,0,0|4,0,0]=4 82 B8R1.4 Clc1cncc(Cl)n1 PI-16282 [0,0,0,0,0,0|4,0,0]=4 83 B8R1.4 Clc1ncnc(Cl)c1 PI-31039 [0,0,0,0,0,0|4,0,0]=4 84 B8R1.4 FC1=CC(=CN=C1)O PI-40460 [0,0,0,0,0,0|2,0,0]=2 85 B8R1.4 Fc1cccc(Cl)c1 PI-33064 [0,0,0,0,0,0|2,0,0]=2 86 B8R1.4 Fc1cccc(c1)F PI-11677 [0,0,0,0,0,0|2,0,0]=2 87 B8R1.4 Fc1cccc(c1)S PI-16910 [0,0,0,0,0,0|1,1,0]=2 88 B8R1.4 Fc1cccc(n1)F PI-11766 [0,0,0,0,0,0|3,0,0]=3 89 B8R1.4 Fc1ccnc(Cl)c1 PI-16761 [0,0,0,0,0,0|3,0,0]=3 90 B8R1.4 Fc1ccnc(c1)Br PI-34451 [0,0,0,0,0,0|3,0,0]=3 91 B8R1.4 Fc1cncc(c1)F PI-33060 [0,0,0,0,0,0|3,0,0]=3 92 B8R1.4 Ic1ccnc(Br)c1 PI-27035 [0,0,0,0,0,0|3,0,0]=3 93 B8R1.4 Ic1ccnc(N)c1 PI-36261 [0,0,0,0,0,0|3,0,0]=3 94 B8R1.4 Ic1ccnc(c1)F PI-34431 [0,0,0,0,0,0|3,0,0]=3 95 B8R1.4 NC1=CC(=CN=C1)F PI-40469 [0,0,0,0,0,0|3,0,0]=3 96 B8R1.4 NC1=CC(N)=NC=C1 PI-37257 [0,0,0,0,0,0|3,0,0]=3 97 B8R1.4 NC1=NC=CC(=C1)F PI-39567 [0,0,0,0,0,0|3,0,0]=3 98 B8R1.4 NC1=NC=CC(=N1)Br PI-40255 [0,0,0,0,0,0|4,0,0]=4 99 B8R1.4 Nc1cc[nH]c(=O)n1 PI-16002 [0,0,0,0,0,0|3,0,1]=4 100 B8R1.4 Nc1cccc(F)c1 PI-16946 [0,0,0,0,0,0|2,0,0]=2 101 B8R1.4 Nc1cccc(F)n1 PI-15934 [0,0,0,0,0,0|3,0,0]=3 102 B8R1.4 Nc1cccc(N)n1 PI-33126 [0,0,0,0,0,0|3,0,0]=3 103 B8R1.4 Nc1cccc(S)c1 PI-21351 [0,0,0,0,0,0|1,1,0]=2 104 B8R1.4 Nc1cccc(n1)Cl PI-27605 [0,0,0,0,0,0|3,0,0]=3 105 B8R1.4 Nc1ccnc(c1)Br PI-23436 [0,0,0,0,0,0|3,0,0]=3 106 B8R1.4 Nc1ccnc(c1)Cl PI-23438 [0,0,0,0,0,0|3,0,0]=3 107 B8R1.4 Nc1cnnc(c1)Cl PI-39012 [0,0,0,0,0,0|4,0,0]=4 108 B8R1.4 Nc1ncnc(c1)Cl PI-21308 [0,0,0,0,0,0|4,0,0]=4 109 B8R1.4 O=C1C=CC=C(Cl)N1 PI-35283 [0,0,0,0,0,0|2,0,1]=3 110 B8R1.4 O=C1NC(C=CN1)=O PI-37339 [0,0,0,0,0,0|3,0,1]=4 111 B8R1.4 OC1=NC=CC(C)=C1 PI-28120 [0,0,0,0,0,0|1,0,0]=1 112 B8R1.4 Oc1cccc(c1)I PI-10955 [0,0,0,0,0,0|1,0,0]=1 113 B8R1.4 Oc1cccc(c1)S PI-21360 [0,0,0,0,0,0|1,0,0]=1 114 B8R1.4 Oc1ccnc(c1)N PI-34188 [0,0,0,0,0,0|2,0,0]=2 115 B8R1.4 Oc1ccnc(n1)Cl PI-38931 [0,0,0,0,0,0|3,0,0]=3 116 B8R1.4 Oc1cncc(c1)Br PI-27886 [0,0,0,0,0,0|2,0,0]=2 117 B8R1.4 Oc1cnnc(n1)S PI-12573 [0,0,0,0,0,0|4,0,0]=4 118 B8R1.4 S=c1cc[nH]c(=O)[nH]1 PI-12580 [0,0,0,0,0,0|3,0,1]=4 119 B8R1.4 Sc1cccc(Cl)c1 PI-11010 [0,0,0,0,0,0|1,1,0]=2 120 B8R1.4 [O-][n+]1cccc(F)c1 PI-33008 [0,0,0,0,0,0|2,0,1]=3 121 B7R1.3 Brc1cccnc1 PI-11914 [1,0,0,0,0,0|2,0,0]=3 122 B7R1.3 Brc1cccnn1 PI-37395 [1,0,0,0,0,0|3,0,0]=4 123 B7R1.3 Brc1ccncc1 PI-10390 [1,0,0,0,0,0|2,0,0]=3 124 B7R1.3 Brc1ccnnc1 PI-34084 [1,0,0,0,0,0|3,0,0]=4 125 B7R1.3 C1=C(C=NC=N1)Br PI-16276 [1,0,0,0,0,0|3,0,0]=4 126 B7R1.3 C1=C(C=NC=N1)Cl PI-21317 [1,0,0,0,0,0|3,0,0]=4 127 B7R1.3 C1=C(C=NC=N1)F PI-28750 [1,0,0,0,0,0|3,0,0]=4 128 B7R1.3 C1=CC(=CN=C1)I PI-11390 [1,0,0,0,0,0|2,0,0]=3 129 B7R1.3 C1=CC(=CN=C1)O PI-44714 [1,0,0,0,0,0|1,0,0]=2 130 B7R1.3 C1=CC(=CN=C1)[O-] PI-42109 [1,0,0,0,0,0|1,0,1]=3 131 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [1,0,0,0,0,0|1,0,1]=3 132 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [1,0,0,0,0,0|1,0,1]=3 133 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [1,0,0,0,0,0|1,0,1]=3 134 B7R1.3 C1=CC(=S)NC=C1 PI-11854 [1,0,0,0,0,0|1,1,0]=3 135 B7R1.3 C1=CC=C(C=C1)[Si] PI-45035 [1,0,0,0,0,0|0,1,0]=2 136 B7R1.3 C1=CC=NC(=C1)I PI-32173 [1,0,0,0,0,0|2,0,0]=3 137 B7R1.3 C1=CN=C(C=N1)Br PI-47341 [1,0,0,0,0,0|3,0,0]=4 138 B7R1.3 C1=CN=C(C=N1)Cl PI-11831 [1,0,0,0,0,0|3,0,0]=4 139 B7R1.3 C1=CN=C(N=C1)N PI-33106 [1,0,0,0,0,0|3,0,0]=4 140 B7R1.3 C1=CN=CC(=S)N1 PI-45037 [1,0,0,0,0,0|2,1,0]=4 141 B7R1.3 C1=CN=CC=C1Cl PI-16703 [1,0,0,0,0,0|2,0,0]=3 142 B7R1.3 C1=CN=CC=C1F PI-10293 [1,0,0,0,0,0|2,0,0]=3 143 B7R1.3 C1=CN=CC=C1F PI-28763 [1,0,0,0,0,0|2,0,0]=3 144 B7R1.3 C1=CN=CC=C1I PI-16167 [1,0,0,0,0,0|2,0,0]=3 145 B7R1.3 C1=CN=CN=C1Cl PI-47317 [1,0,0,0,0,0|3,0,0]=4 146 B7R1.3 C1=CN=CN=C1N PI-34789 [1,0,0,0,0,0|3,0,0]=4 147 B7R1.3 C1=CN=CNC1=O PI-21341 [1,0,0,0,0,0|2,0,1]=4 148 B7R1.3 C1=CN=CNC1=O PI-45002 [1,0,0,0,0,0|2,0,1]=4 149 B7R1.3 C1=CNC(=O)N=C1 PI-32626 [1,0,0,0,0,0|2,0,1]=4 150 B7R1.3 C1=CNC(=O)N=C1 PI-33107 [1,0,0,0,0,0|2,0,1]=4 151 B7R1.3 C1=CNC(=S)N=C1 PI-15316 [1,0,0,0,0,0|2,1,0]=4 152 B7R1.3 C1=CNC=CC1=S PI-33123 [1,0,0,0,0,0|1,1,0]=3 153 B7R1.3 C1=COC=CC1=O PI-43972 [1,0,0,0,0,0|1,0,1]=3 154 B7R1.3 C1=C[N+](=CC=N1)[O-] PI-50198 [1,0,0,0,0,0|2,0,1]=4 155 B7R1.3 CC1=CC=CC=N1 PI-38534 [1,0,0,0,0,0|1,0,0]=2 156 B7R1.3 CC1=CN=CN=C1 PI-21343 [1,0,0,0,0,0|2,0,0]=3 157 B7R1.3 CC1=CN=NC=C1 PI-31701 [1,0,0,0,0,0|2,0,0]=3 158 B7R1.3 CC1=NC=CN=C1 PI-48495 [1,0,0,0,0,0|2,0,0]=3 159 B7R1.3 C[N+]1=CC=CC=C1 PI-13346 [1,0,0,0,0,0|1,0,0]=2 160 B7R1.3 C[n+]1ccccc1 PI-17168 [1,0,0,0,0,0|1,0,0]=2 161 B7R1.3 Cc1ncccn1 PI-35192 [1,0,0,0,0,0|2,0,0]=3 162 B7R1.3 ClC1=NN=CC=C1 PI-37010 [1,0,0,0,0,0|3,0,0]=4 163 B7R1.3 Clc1cccnc1 PI-11921 [1,0,0,0,0,0|2,0,0]=3 164 B7R1.3 Clc1ccncn1 PI-38789 [1,0,0,0,0,0|3,0,0]=4 165 B7R1.3 Clc1ncccn1 PI-16275 [1,0,0,0,0,0|3,0,0]=4 166 B7R1.3 Fc1ccccn1 PI-11583 [1,0,0,0,0,0|2,0,0]=3 167 B7R1.3 Fc1cccnc1 PI-16759 [1,0,0,0,0,0|2,0,0]=3 168 B7R1.3 Ic1ccccc1 PI-37973 [1,0,0,0,0,0|1,0,0]=2 169 B7R1.3 Ic1cnccn1 PI-38885 [1,0,0,0,0,0|3,0,0]=4 170 B7R1.3 N[n+]1ccccc1 PI-10984 [1,0,0,0,0,0|2,0,0]=3 171 B7R1.3 Nc1cccnn1 PI-38601 [1,0,0,0,0,0|3,0,0]=4 172 B7R1.3 Nc1ccnnc1 PI-35933 [1,0,0,0,0,0|3,0,0]=4 173 B7R1.3 Nc1cnccn1 PI-29636 [1,0,0,0,0,0|3,0,0]=4 174 B7R1.3 Nc1cncnc1 PI-38883 [1,0,0,0,0,0|3,0,0]=4 175 B7R1.3 O=C1C=CC=NN1 PI-40006 [1,0,0,0,0,0|2,0,1]=4 176 B7R1.3 O=C1C=CNC=C1 PI-33984 [1,0,0,0,0,0|1,0,1]=3 177 B7R1.3 Oc1cncnc1 PI-36495 [1,0,0,0,0,0|2,0,0]=3 178 B7R1.3 [S-]c1ccccc1 PI-17985 [1,0,0,0,0,0|0,1,0]=2 179 B9R1.2 BrCc1cccc(I)c1 PI-29628 [0,1,0,0,0,0|1,0,0]=2 180 B9R1.2 BrCc1cccc(c1)Br PI-13393 [0,1,0,0,0,0|1,0,0]=2 181 B9R1.2 BrCc1cccc(c1)Cl PI-23167 [0,1,0,0,0,0|1,0,0]=2 182 B9R1.2 Brc1cc(C=O)ncc1 PI-38308 [0,1,0,0,0,0|2,0,1]=4 183 B9R1.2 C#CC1=CC(=CC=C1)Br PI-30913 [0,1,0,0,0,0|1,0,1]=3 184 B9R1.2 C#CC1=CC(=CC=C1)Cl PI-30914 [0,1,0,0,0,0|1,0,1]=3 185 B9R1.2 C#CC1=CC(=CC=C1)F PI-30388 [0,1,0,0,0,0|1,0,1]=3 186 B9R1.2 C#Cc1cccc(N)c1 PI-10850 [0,1,0,0,0,0|1,0,1]=3 187 B9R1.2 C1=C(C=NC=C1Br)C#N PI-21589 [0,1,0,0,0,0|2,0,1]=4 188 B9R1.2 C1=C(C=NC=C1Br)CO PI-47170 [0,1,0,0,0,0|2,0,0]=3 189 B9R1.2 C1=C(C=NC=C1Cl)CO PI-34717 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.2 C1=C(C=NC=C1F)NN PI-48989 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.2 C1=C(C=NC=C1N)C#N PI-36516 [0,1,0,0,0,0|2,0,1]=4 192 B9R1.2 C1=CC(=CC(=C1)Br)C#N PI-30857 [0,1,0,0,0,0|1,0,1]=3 193 B9R1.2 C1=CC(=CC(=C1)Br)CCl PI-35258 [0,1,0,0,0,0|1,0,0]=2 194 B9R1.2 C1=CC(=CC(=C1)Br)CO PI-10954 [0,1,0,0,0,0|1,0,0]=2 195 B9R1.2 C1=CC(=CC(=C1)Cl)CCl PI-34222 [0,1,0,0,0,0|1,0,0]=2 196 B9R1.2 C1=CC(=CC(=C1)Cl)NN PI-29369 [0,1,0,0,0,0|2,0,0]=3 197 B9R1.2 C1=CC(=CC(=C1)F)CBr PI-13389 [0,1,0,0,0,0|1,0,0]=2 198 B9R1.2 C1=CC(=CC(=C1)F)CCl PI-34129 [0,1,0,0,0,0|1,0,0]=2 199 B9R1.2 C1=CC(=CC(=C1)F)CO PI-16873 [0,1,0,0,0,0|1,0,0]=2 200 B9R1.2 C1=CC(=CC(=C1)F)NN PI-29439 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.2 C1=CC(=CC(=C1)I)C=O PI-27854 [0,1,0,0,0,0|1,0,1]=3 202 B9R1.2 C1=CC(=CC(=C1)N)C=O PI-27126 [0,1,0,0,0,0|1,0,1]=3 203 B9R1.2 C1=CC(=CC(=C1)O)C#N PI-35245 [0,1,0,0,0,0|0,0,1]=2 204 B9R1.2 C1=CC(=CC(=C1)O)CBr PI-43991 [0,1,0,0,0,0|0,0,0]=1 205 B9R1.2 C1=CC(=CC(=C1)O)CO PI-11929 [0,1,0,0,0,0|0,0,0]=1 206 B9R1.2 C1=CC(=C[N+](=C1)[O-])C#N PI-30158 [0,1,0,0,0,0|1,0,2]=4 207 B9R1.2 C1=CC(=NC(=C1)Br)C=O PI-21494 [0,1,0,0,0,0|2,0,1]=4 208 B9R1.2 C1=CC(=NC(=C1)Br)CBr PI-34987 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.2 C1=CC(=NC(=C1)Br)CN PI-34988 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.2 C1=CC(=NC(=C1)Br)CO PI-11552 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.2 C1=CC(=NC(=C1)Br)NN PI-34719 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.2 C1=CC(=NC(=C1)Cl)CO PI-35291 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.2 C1=CC(=NC(=C1)Cl)CO PI-35292 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.2 C1=CN=C(C=C1C#N)Br PI-38893 [0,1,0,0,0,0|2,0,1]=4 215 B9R1.2 C1=CN=C(C=C1CBr)Br PI-40971 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.2 C1=CN=C(C=C1CO)Br PI-27098 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.2 C1=CN=C(C=C1CO)F PI-44971 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.2 C1=CN=C(C=C1Cl)C#N PI-40241 [0,1,0,0,0,0|2,0,1]=4 219 B9R1.2 C1=CN=C(C=C1Cl)CO PI-34715 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.2 C=CC1=CC(=CC=C1)Br PI-22598 [0,1,0,0,0,0|1,0,1]=3 221 B9R1.2 C=Cc1cccc(c1)C PI-40767 [0,1,0,0,0,0|1,0,0]=2 222 B9R1.2 CC1=CC(=CC=C1)C=O PI-11938 [0,1,0,0,0,0|0,0,1]=2 223 B9R1.2 CC1=CC(=CC=C1)CN PI-35861 [0,1,0,0,0,0|1,0,0]=2 224 B9R1.2 CC1=CC(=CN=C1)C=O PI-43924 [0,1,0,0,0,0|1,0,1]=3 225 B9R1.2 CC1=CC(=NC=C1)C#N PI-11834 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.2 CC1=CC=CC(=N1)C#N PI-44998 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.2 CC1=NC(=CC=C1)C=C PI-27081 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.2 CC1=NC(=CC=C1)C=O PI-16691 [0,1,0,0,0,0|1,0,1]=3 229 B9R1.2 CC1=NC(=CC=C1)NN PI-36907 [0,1,0,0,0,0|2,0,0]=3 230 B9R1.2 CC1=NC(=CC=C1)OC PI-10858 [0,1,0,0,0,0|1,0,0]=2 231 B9R1.2 CC1=NC=CC(=N1)OC PI-44930 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.2 CCC1=CC(=CC=C1)Br PI-21410 [0,1,0,0,0,0|1,0,0]=2 233 B9R1.2 CCC1=CC(=NC=C1)Br PI-24478 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.2 CCC1=CC(=NC=N1)Cl PI-47323 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.2 CCc1cccc(N)n1 PI-30318 [0,1,0,0,0,0|2,0,0]=3 236 B9R1.2 CCc1ccnc(c1)N PI-30483 [0,1,0,0,0,0|2,0,0]=3 237 B9R1.2 CNC1=CC(=NC=N1)Cl PI-34619 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.2 CNc1cccc(c1)F PI-29299 [0,1,0,0,0,0|1,0,0]=2 239 B9R1.2 COC1=CC(=CC=C1)Br PI-12683 [0,1,0,0,0,0|1,0,0]=2 240 B9R1.2 COC1=CC(=CC=C1)S PI-13025 [0,1,0,0,0,0|0,1,0]=2 241 B9R1.2 COC1=CC(=NC=C1)Cl PI-27253 [0,1,0,0,0,0|2,0,0]=3 242 B9R1.2 COC1=CC(=NC=C1)N PI-31930 [0,1,0,0,0,0|2,0,0]=3 243 B9R1.2 COC1=CC(=NC=N1)Cl PI-16342 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.2 COC1=CC(=O)NC=C1 PI-47311 [0,1,0,0,0,0|1,0,1]=3 245 B9R1.2 COC1=CC(Cl)=CC=C1 PI-31362 [0,1,0,0,0,0|1,0,0]=2 246 B9R1.2 COC1=CC(F)=CC=C1 PI-12220 [0,1,0,0,0,0|1,0,0]=2 247 B9R1.2 COC1=NC(=CC=C1)Br PI-34471 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.2 COC1=NC(=NC=C1)Br PI-45082 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.2 COC1=NC(=NC=C1)Cl PI-45081 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.2 COC1=NC=CC(=C1)I PI-36520 [0,1,0,0,0,0|2,0,0]=3 251 B9R1.2 COC1=NC=CC(Br)=N1 PI-46750 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.2 COC1=NC=NC(=C1)N PI-11959 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.2 COc1cc(Br)cnc1 PI-38259 [0,1,0,0,0,0|2,0,0]=3 254 B9R1.2 COc1cc(Cl)ccn1 PI-26867 [0,1,0,0,0,0|2,0,0]=3 255 B9R1.2 COc1cc(N)ccn1 PI-26277 [0,1,0,0,0,0|2,0,0]=3 256 B9R1.2 COc1cc(N)cnc1 PI-33855 [0,1,0,0,0,0|2,0,0]=3 257 B9R1.2 COc1cccc(c1)O PI-34658 [0,1,0,0,0,0|0,0,0]=1 258 B9R1.2 COc1ccnc(I)n1 PI-36437 [0,1,0,0,0,0|3,0,0]=4 259 B9R1.2 CSC1=CC(=CC=C1)Br PI-11915 [0,1,0,0,0,0|1,0,0]=2 260 B9R1.2 CSC1=CC(=CC=C1)Cl PI-20243 [0,1,0,0,0,0|1,0,0]=2 261 B9R1.2 CSC1=CC(Cl)=NC=N1 PI-46773 [0,1,0,0,0,0|3,0,0]=4 262 B9R1.2 CSC1=NC=CC(Br)=N1 PI-46740 [0,1,0,0,0,0|3,0,0]=4 263 B9R1.2 CSc1cccc(c1)N PI-11908 [0,1,0,0,0,0|1,0,0]=2 264 B9R1.2 CSc1ccnc(Cl)n1 PI-33601 [0,1,0,0,0,0|3,0,0]=4 265 B9R1.2 CSc1nc(Cl)ccn1 PI-34777 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.2 Clc1cc(C=O)ncc1 PI-39303 [0,1,0,0,0,0|2,0,1]=4 267 B9R1.2 Clc1cccc(c1)C#N PI-31301 [0,1,0,0,0,0|1,0,1]=3 268 B9R1.2 FC1=NC(=CC=C1)C=O PI-39667 [0,1,0,0,0,0|2,0,1]=4 269 B9R1.2 Fc1cc(cnc1)C#N PI-38882 [0,1,0,0,0,0|2,0,1]=4 270 B9R1.2 N#Cc1cccc(F)c1 PI-16864 [0,1,0,0,0,0|1,0,1]=3 271 B9R1.2 N#Cc1cccc(c1)I PI-10114 [0,1,0,0,0,0|1,0,1]=3 272 B9R1.2 N#Cc1cccc(n1)Br PI-44992 [0,1,0,0,0,0|2,0,1]=4 273 B9R1.2 N#Cc1ccnc(Cl)c1 PI-10231 [0,1,0,0,0,0|2,0,1]=4 274 B9R1.2 N#Cc1ccnc(N)c1 PI-10170 [0,1,0,0,0,0|2,0,1]=4 275 B9R1.2 N#Cc1ccnc(O)c1 PI-20781 [0,1,0,0,0,0|1,0,1]=3 276 B9R1.2 NCc1cc(Br)ccn1 PI-39476 [0,1,0,0,0,0|2,0,0]=3 277 B9R1.2 NCc1cccc(Cl)c1 PI-15673 [0,1,0,0,0,0|1,0,0]=2 278 B9R1.2 NCc1cccc(c1)Br PI-21372 [0,1,0,0,0,0|1,0,0]=2 279 B9R1.2 NCc1cccc(c1)Br PI-38545 [0,1,0,0,0,0|1,0,0]=2 280 B9R1.2 NCc1cccc(c1)F PI-23480 [0,1,0,0,0,0|1,0,0]=2 281 B9R1.2 NNc1cccc(Cl)n1 PI-34718 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.2 NNc1cccc(c1)Br PI-29422 [0,1,0,0,0,0|2,0,0]=3 283 B9R1.2 NNc1cccc(c1)C PI-29814 [0,1,0,0,0,0|1,0,0]=2 284 B9R1.2 O=C1NC(SC)=NC=C1 PI-12294 [0,1,0,0,0,0|2,0,1]=4 285 B9R1.2 O=Cc1cccc(c1)Br PI-34503 [0,1,0,0,0,0|1,0,1]=3 286 B9R1.2 O=Cc1cccc(c1)Cl PI-27742 [0,1,0,0,0,0|1,0,1]=3 287 B9R1.2 O=Cc1cccc(c1)F PI-11925 [0,1,0,0,0,0|1,0,1]=3 288 B9R1.2 O=Cc1cccc(c1)N PI-11906 [0,1,0,0,0,0|1,0,1]=3 289 B9R1.2 O=Cc1cccc(c1)O PI-34273 [0,1,0,0,0,0|0,0,1]=2 290 B9R1.2 O=Cc1ccnc(C)n1 PI-33598 [0,1,0,0,0,0|2,0,1]=4 291 B9R1.2 O=Cc1ccnc(c1)Br PI-27099 [0,1,0,0,0,0|2,0,1]=4 292 B9R1.2 O=Cc1ccnc(c1)Cl PI-31791 [0,1,0,0,0,0|2,0,1]=4 293 B9R1.2 OCC1=CC(C)=NC=C1 PI-36994 [0,1,0,0,0,0|1,0,0]=2 294 B9R1.2 OCC1=CC(N)=CN=C1 PI-35898 [0,1,0,0,0,0|2,0,0]=3 295 B9R1.2 OCc1cccc(c1)C PI-38620 [0,1,0,0,0,0|0,0,0]=1 296 B9R1.2 OCc1cccc(c1)Cl PI-11919 [0,1,0,0,0,0|1,0,0]=2 297 B9R1.2 SCc1cccc(F)c1 PI-23495 [0,1,0,0,0,0|1,0,0]=2 298 B9R1.2 [C-]#[N+]C1=CC(=CC=C1)Br PI-22496 [0,1,0,0,0,0|1,0,1]=3 299 B9R1.3 BrC1=C(C=CC=C1F)N PI-10616 [0,1,0,0,0,0|2,0,0]=3 300 B9R1.3 Brc1c(Cl)cccc1Br PI-36772 [0,1,0,0,0,0|2,0,0]=3 301 B9R1.3 Brc1c(N)ccnc1N PI-39323 [0,1,0,0,0,0|3,0,0]=4 302 B9R1.3 Brc1c(O)cccc1F PI-27596 [0,1,0,0,0,0|1,0,0]=2 303 B9R1.3 Brc1cccc(c1C)Br PI-30854 [0,1,0,0,0,0|2,0,0]=3 304 B9R1.3 Brc1cccc(c1F)Br PI-38886 [0,1,0,0,0,0|2,0,0]=3 305 B9R1.3 Brc1cncc(c1C)Br PI-39130 [0,1,0,0,0,0|3,0,0]=4 306 B9R1.3 C1=C(C(=C(C=C1)F)O)O PI-19501 [0,1,0,0,0,0|1,0,0]=2 307 B9R1.3 C1=C(C(=C(C=N1)Cl)Br)Cl PI-28407 [0,1,0,0,0,0|3,0,0]=4 308 B9R1.3 C1=C(C(=C(C=N1)Cl)N)Cl PI-16166 [0,1,0,0,0,0|3,0,0]=4 309 B9R1.3 C1=C(C(=C(C=N1)N)N)N PI-35294 [0,1,0,0,0,0|3,0,0]=4 310 B9R1.3 C1=C(C(=O)C(=CN1)Cl)Cl PI-28203 [0,1,0,0,0,0|3,0,0]=4 311 B9R1.3 C1=CC(=C(C(=C1)Br)Br)Br PI-49334 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.3 C1=CC(=C(C(=C1)Br)Br)F PI-43232 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)O PI-34265 [0,1,0,0,0,0|1,0,0]=2 314 B9R1.3 C1=CC(=C(C(=C1)Br)I)O PI-44588 [0,1,0,0,0,0|1,0,0]=2 315 B9R1.3 C1=CC(=C(C(=C1)Br)N)F PI-28732 [0,1,0,0,0,0|2,0,0]=3 316 B9R1.3 C1=CC(=C(C(=C1)Br)O)F PI-10646 [0,1,0,0,0,0|2,0,0]=3 317 B9R1.3 C1=CC(=C(C(=C1)Br)O)N PI-33348 [0,1,0,0,0,0|2,0,0]=3 318 B9R1.3 C1=CC(=C(C(=C1)Cl)Br)Cl PI-33015 [0,1,0,0,0,0|2,0,0]=3 319 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)F PI-21033 [0,1,0,0,0,0|2,0,0]=3 320 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)S PI-21353 [0,1,0,0,0,0|1,1,0]=3 321 B9R1.3 C1=CC(=C(C(=C1)Cl)F)F PI-28648 [0,1,0,0,0,0|2,0,0]=3 322 B9R1.3 C1=CC(=C(C(=C1)Cl)N)F PI-16936 [0,1,0,0,0,0|2,0,0]=3 323 B9R1.3 C1=CC(=C(C(=C1)Cl)N)S PI-41796 [0,1,0,0,0,0|1,1,0]=3 324 B9R1.3 C1=CC(=C(C(=C1)Cl)O)F PI-16877 [0,1,0,0,0,0|2,0,0]=3 325 B9R1.3 C1=CC(=C(C(=C1)Cl)S)Cl PI-17253 [0,1,0,0,0,0|2,0,0]=3 326 B9R1.3 C1=CC(=C(C(=C1)F)Cl)F PI-28470 [0,1,0,0,0,0|2,0,0]=3 327 B9R1.3 C1=CC(=C(C(=C1)F)F)F PI-28163 [0,1,0,0,0,0|2,0,0]=3 328 B9R1.3 C1=CC(=C(C(=C1)F)F)N PI-28539 [0,1,0,0,0,0|2,0,0]=3 329 B9R1.3 C1=CC(=C(C(=C1)F)I)F PI-34348 [0,1,0,0,0,0|2,0,0]=3 330 B9R1.3 C1=CC(=C(C(=C1)I)Br)F PI-42952 [0,1,0,0,0,0|2,0,0]=3 331 B9R1.3 C1=CC(=C(C(=C1)I)Cl)Cl PI-31839 [0,1,0,0,0,0|2,0,0]=3 332 B9R1.3 C1=CC(=C(C(=C1)I)N)F PI-34647 [0,1,0,0,0,0|2,0,0]=3 333 B9R1.3 C1=CC(=C(C(=C1)O)Cl)N PI-34749 [0,1,0,0,0,0|1,0,0]=2 334 B9R1.3 C1=CC(=C(C(=C1)O)F)N PI-49267 [0,1,0,0,0,0|1,0,0]=2 335 B9R1.3 C1=CC=C(C(=C1Br)C)N PI-19715 [0,1,0,0,0,0|2,0,0]=3 336 B9R1.3 C1=CC=C(O)C(=C1O)Cl PI-10240 [0,1,0,0,0,0|1,0,0]=2 337 B9R1.3 C1=CN=C(C(=C1I)F)Cl PI-34445 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.3 C1=CN=C(C(=C1N)I)Cl PI-50550 [0,1,0,0,0,0|3,0,0]=4 339 B9R1.3 C1=NC(=C(C(=O)N1)Br)O PI-16305 [0,1,0,0,0,0|3,0,0]=4 340 B9R1.3 C1=NC(=C(C(=O)N1)F)O PI-45140 [0,1,0,0,0,0|3,0,0]=4 341 B9R1.3 CC1=C(Br)C(F)=NC=C1 PI-39751 [0,1,0,0,0,0|2,0,0]=3 342 B9R1.3 CC1=C(C(=CC=C1)Br)F PI-10666 [0,1,0,0,0,0|1,0,0]=2 343 B9R1.3 CC1=C(C(=CC=C1)Br)N PI-21583 [0,1,0,0,0,0|1,0,0]=2 344 B9R1.3 CC1=C(C(=CC=C1)Br)O PI-46963 [0,1,0,0,0,0|1,0,0]=2 345 B9R1.3 CC1=C(C(=CC=C1)C)Cl PI-11596 [0,1,0,0,0,0|1,0,0]=2 346 B9R1.3 CC1=C(C(=CC=C1)C)F PI-11594 [0,1,0,0,0,0|1,0,0]=2 347 B9R1.3 CC1=C(C(=CC=C1)C)O PI-48960 [0,1,0,0,0,0|1,0,0]=2 348 B9R1.3 CC1=C(C(=CC=C1)C)S PI-19078 [0,1,0,0,0,0|1,0,0]=2 349 B9R1.3 CC1=C(C(=CC=C1)Cl)Br PI-19844 [0,1,0,0,0,0|1,0,0]=2 350 B9R1.3 CC1=C(C(=CC=C1)Cl)F PI-28868 [0,1,0,0,0,0|1,0,0]=2 351 B9R1.3 CC1=C(C(=CC=C1)Cl)I PI-19664 [0,1,0,0,0,0|1,0,0]=2 352 B9R1.3 CC1=C(C(=CC=C1)F)Br PI-33074 [0,1,0,0,0,0|1,0,0]=2 353 B9R1.3 CC1=C(C(=CC=C1)F)F PI-16367 [0,1,0,0,0,0|1,0,0]=2 354 B9R1.3 CC1=C(C(=CC=C1)F)I PI-34489 [0,1,0,0,0,0|1,0,0]=2 355 B9R1.3 CC1=C(C(=CC=C1)F)N PI-10462 [0,1,0,0,0,0|1,0,0]=2 356 B9R1.3 CC1=C(C(=CC=C1)I)F PI-10671 [0,1,0,0,0,0|1,0,0]=2 357 B9R1.3 CC1=C(C(=CC=C1)N)C PI-27689 [0,1,0,0,0,0|1,0,0]=2 358 B9R1.3 CC1=C(C(=CC=C1)N)F PI-28254 [0,1,0,0,0,0|1,0,0]=2 359 B9R1.3 CC1=C(C(=CC=C1)N)N PI-20954 [0,1,0,0,0,0|1,0,0]=2 360 B9R1.3 CC1=C(C(=CC=C1)N)O PI-42097 [0,1,0,0,0,0|1,0,0]=2 361 B9R1.3 CC1=C(C(=CC=C1)O)Cl PI-42107 [0,1,0,0,0,0|0,0,0]=1 362 B9R1.3 CC1=C(C(=NC=C1)Cl)N PI-10382 [0,1,0,0,0,0|2,0,0]=3 363 B9R1.3 CC1=C(C(=NC=N1)C)N PI-45080 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.3 CC1=C(C(=NC=N1)C)O PI-45131 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.3 CC1=C(C(=NC=N1)Cl)F PI-45135 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.3 CC1=C(C(=O)NC=N1)I PI-47321 [0,1,0,0,0,0|2,0,1]=4 367 B9R1.3 CC1=C(C)C(F)=CC=C1 PI-11597 [0,1,0,0,0,0|1,0,0]=2 368 B9R1.3 CC1=C(C=CC=C1Br)Cl PI-20670 [0,1,0,0,0,0|2,0,0]=3 369 B9R1.3 CC1=C(C=CC=C1Br)F PI-10665 [0,1,0,0,0,0|2,0,0]=3 370 B9R1.3 CC1=C(C=CC=C1F)F PI-10670 [0,1,0,0,0,0|2,0,0]=3 371 B9R1.3 CC1=C(C=CC=C1F)N PI-28534 [0,1,0,0,0,0|2,0,0]=3 372 B9R1.3 CC1=C(C=CC=C1F)O PI-33695 [0,1,0,0,0,0|1,0,0]=2 373 B9R1.3 CC1=C(C=CC=C1I)F PI-10674 [0,1,0,0,0,0|2,0,0]=3 374 B9R1.3 CC1=C(Cl)C(Cl)=CC=C1 PI-27484 [0,1,0,0,0,0|1,0,0]=2 375 B9R1.3 CC1=[N+](C(=CC=C1)C)[O-] PI-29049 [0,1,0,0,0,0|2,0,0]=3 376 B9R1.3 Cc1c(C)cccc1Br PI-38905 [0,1,0,0,0,0|1,0,0]=2 377 B9R1.3 Cc1c(F)cccc1Cl PI-33407 [0,1,0,0,0,0|2,0,0]=3 378 B9R1.3 Cc1c(O)cccc1O PI-13269 [0,1,0,0,0,0|1,0,0]=2 379 B9R1.3 Cc1cccc(c1Br)C PI-11595 [0,1,0,0,0,0|1,0,0]=2 380 B9R1.3 Cc1ccnc(c1F)Cl PI-34473 [0,1,0,0,0,0|2,0,0]=3 381 B9R1.3 ClC1=CC=CC(Br)=C1I PI-41926 [0,1,0,0,0,0|2,0,0]=3 382 B9R1.3 Clc1c(N)cccc1F PI-10619 [0,1,0,0,0,0|2,0,0]=3 383 B9R1.3 Clc1c(O)cccc1Cl PI-37792 [0,1,0,0,0,0|1,0,0]=2 384 B9R1.3 Clc1cccc(Cl)[n+]1[O-] PI-42561 [0,1,0,0,0,0|3,0,0]=4 385 B9R1.3 Clc1cncc(Cl)c1Cl PI-33527 [0,1,0,0,0,0|3,0,0]=4 386 B9R1.3 Clc1cncc(c1F)Cl PI-28912 [0,1,0,0,0,0|3,0,0]=4 387 B9R1.3 F[n+]1c(Cl)cccc1Cl PI-23568 [0,1,0,0,0,0|3,0,0]=4 388 B9R1.3 Fc1c(C)cccc1O PI-38225 [0,1,0,0,0,0|0,0,0]=1 389 B9R1.3 Fc1c(Cl)cccc1Br PI-11590 [0,1,0,0,0,0|2,0,0]=3 390 B9R1.3 Fc1c(Cl)cccc1I PI-20091 [0,1,0,0,0,0|2,0,0]=3 391 B9R1.3 Fc1c(F)cccc1Br PI-16365 [0,1,0,0,0,0|2,0,0]=3 392 B9R1.3 Fc1c(N)cccc1Br PI-38904 [0,1,0,0,0,0|2,0,0]=3 393 B9R1.3 Fc1c(O)cccc1F PI-10291 [0,1,0,0,0,0|1,0,0]=2 394 B9R1.3 Fc1cccc(c1Br)F PI-16368 [0,1,0,0,0,0|2,0,0]=3 395 B9R1.3 Fc1cccc(c1N)F PI-31231 [0,1,0,0,0,0|2,0,0]=3 396 B9R1.3 IC1=C(Br)C=CC=C1Br PI-46843 [0,1,0,0,0,0|2,0,0]=3 397 B9R1.3 NC1=C(N)C=CN=C1Cl PI-35295 [0,1,0,0,0,0|3,0,0]=4 398 B9R1.3 Nc1c(C)cccc1Cl PI-12044 [0,1,0,0,0,0|1,0,0]=2 399 B9R1.3 Nc1c(C)cccc1O PI-11311 [0,1,0,0,0,0|0,0,0]=1 400 B9R1.3 Nc1c(Cl)cccc1I PI-36760 [0,1,0,0,0,0|2,0,0]=3 401 B9R1.3 Nc1c(N)ncnc1O PI-34788 [0,1,0,0,0,0|3,0,0]=4 402 B9R1.3 Nc1c(O)cccc1Br PI-36538 [0,1,0,0,0,0|1,0,0]=2 403 B9R1.3 Nc1ccnc(Cl)c1Br PI-37155 [0,1,0,0,0,0|3,0,0]=4 404 B9R1.3 OC1=C(F)C(Br)=CC=C1 PI-40482 [0,1,0,0,0,0|1,0,0]=2 405 B9R1.3 OC1=C(F)C=CC=C1F PI-16916 [0,1,0,0,0,0|2,0,0]=3 406 B9R1.3 Oc1c(Br)cccc1Br PI-20984 [0,1,0,0,0,0|2,0,0]=3 407 B9R1.3 Oc1c(C)cccc1Cl PI-20168 [0,1,0,0,0,0|1,0,0]=2 408 B9R1.3 Oc1c(F)cccc1I PI-10652 [0,1,0,0,0,0|2,0,0]=3 409 B9R1.3 Oc1c(N)cccc1F PI-34504 [0,1,0,0,0,0|2,0,0]=3 410 B9R1.3 Oc1cccc(c1N)O PI-32329 [0,1,0,0,0,0|1,0,0]=2 411 B9R1.34 Brc1cc(Br)cc(Br)c1 PI-11674 [0,1,0,0,0,0|2,0,0]=3 412 B9R1.34 C1=C(C=C(C=C1Br)Br)F PI-28148 [0,1,0,0,0,0|2,0,0]=3 413 B9R1.34 C1=C(C=C(C=C1Br)Br)O PI-34092 [0,1,0,0,0,0|1,0,0]=2 414 B9R1.34 C1=C(C=C(C=C1Cl)Br)F PI-11589 [0,1,0,0,0,0|2,0,0]=3 415 B9R1.34 C1=C(C=C(C=C1Cl)Br)O PI-34267 [0,1,0,0,0,0|1,0,0]=2 416 B9R1.34 C1=C(C=C(C=C1Cl)Cl)F PI-21034 [0,1,0,0,0,0|2,0,0]=3 417 B9R1.34 C1=C(C=C(C=C1Cl)Cl)S PI-17419 [0,1,0,0,0,0|1,1,0]=3 418 B9R1.34 C1=C(C=C(C=C1F)F)F PI-28455 [0,1,0,0,0,0|2,0,0]=3 419 B9R1.34 C1=C(C=C(C=C1F)F)N PI-16948 [0,1,0,0,0,0|2,0,0]=3 420 B9R1.34 C1=C(C=C(C=C1F)I)F PI-28290 [0,1,0,0,0,0|2,0,0]=3 421 B9R1.34 C1=C(C=C(C=C1I)I)O PI-35825 [0,1,0,0,0,0|1,0,0]=2 422 B9R1.34 C1=C(C=C(N=C1N)N)Br PI-33870 [0,1,0,0,0,0|3,0,0]=4 423 B9R1.34 C1=C(C=[N+](C=C1Br)[O-])Br PI-42575 [0,1,0,0,0,0|2,0,1]=4 424 B9R1.34 C1=C(C=[N+](C=C1Cl)[O-])Cl PI-42562 [0,1,0,0,0,0|2,0,1]=4 425 B9R1.34 CC1=CC(=CC(=C1)Br)Br PI-30186 [0,1,0,0,0,0|1,0,0]=2 426 B9R1.34 CC1=CC(=CC(=C1)Br)F PI-10667 [0,1,0,0,0,0|1,0,0]=2 427 B9R1.34 CC1=CC(=CC(=C1)Cl)C PI-19721 [0,1,0,0,0,0|1,0,0]=2 428 B9R1.34 CC1=CC(=CC(=C1)Cl)F PI-19987 [0,1,0,0,0,0|1,0,0]=2 429 B9R1.34 CC1=CC(=CC(=C1)F)C PI-21948 [0,1,0,0,0,0|1,0,0]=2 430 B9R1.34 CC1=CC(=CC(=C1)O)O PI-10527 [0,1,0,0,0,0|0,0,0]=1 431 B9R1.34 CC1=CC(=CC(=N1)C)Br PI-35010 [0,1,0,0,0,0|2,0,0]=3 432 B9R1.34 CC1=CC(=CC(=N1)C)Cl PI-35009 [0,1,0,0,0,0|2,0,0]=3 433 B9R1.34 CC1=CC(=CC(=N1)C)I PI-35012 [0,1,0,0,0,0|2,0,0]=3 434 B9R1.34 CC1=CC(=C[N+](=C1)[O-])C PI-42565 [0,1,0,0,0,0|1,0,1]=3 435 B9R1.34 CC1=CC(=NC(=C1)C)C PI-20726 [0,1,0,0,0,0|2,0,0]=3 436 B9R1.34 CC1=CC(=NC(=C1)N)C PI-30696 [0,1,0,0,0,0|2,0,0]=3 437 B9R1.34 CC1=CC(=NC(=N1)C)Cl PI-21319 [0,1,0,0,0,0|3,0,0]=4 438 B9R1.34 CC1=CC(=NC(=N1)Cl)C PI-21318 [0,1,0,0,0,0|3,0,0]=4 439 B9R1.34 CC1=CC(=NC(=N1)N)Cl PI-33699 [0,1,0,0,0,0|3,0,0]=4 440 B9R1.34 CC1=CC(=NC(=O)N1)C PI-31788 [0,1,0,0,0,0|2,0,1]=4 441 B9R1.34 CC1=CC(=O)NC(=N1)C PI-21333 [0,1,0,0,0,0|2,0,1]=4 442 B9R1.34 CC1=CC(=[O+]C(=C1)C)C PI-47145 [0,1,0,0,0,0|2,0,0]=3 443 B9R1.34 CC1=NC(=CC(=O)N1)O PI-12843 [0,1,0,0,0,0|2,0,0]=3 444 B9R1.34 Cc1[c-]c(O)[c-]c([c-]1)O PI-10851 [0,1,0,0,0,0|0,0,3]=4 445 B9R1.34 Cc1cc(=O)[nH]c(=S)[nH]1 PI-13213 [0,1,0,0,0,0|2,0,1]=4 446 B9R1.34 Cc1cc(C)cc(S)c1 PI-22000 [0,1,0,0,0,0|0,1,0]=2 447 B9R1.34 Cc1cc(C)cc(c1)Br PI-38330 [0,1,0,0,0,0|1,0,0]=2 448 B9R1.34 Cc1cc(C)nc(C)c1 PI-32521 [0,1,0,0,0,0|2,0,0]=3 449 B9R1.34 Cc1cc(C)nc(N)n1 PI-12876 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.34 Cc1cc(C)nc(S)n1 PI-33476 [0,1,0,0,0,0|2,1,0]=4 451 B9R1.34 Cc1cc(Cl)nc(n1)Cl PI-31224 [0,1,0,0,0,0|3,0,0]=4 452 B9R1.34 Cc1cc(F)cc(c1)F PI-33075 [0,1,0,0,0,0|1,0,0]=2 453 B9R1.34 Cc1cc(N)cc(c1)Cl PI-39722 [0,1,0,0,0,0|1,0,0]=2 454 B9R1.34 Cc1cc(N)cc(c1)F PI-10625 [0,1,0,0,0,0|1,0,0]=2 455 B9R1.34 Cc1cc(N)nc(C)n1 PI-33478 [0,1,0,0,0,0|3,0,0]=4 456 B9R1.34 Cc1cc(O)cc(c1)Br PI-33356 [0,1,0,0,0,0|0,0,0]=1 457 B9R1.34 Cc1cc(O)nc(N)n1 PI-33693 [0,1,0,0,0,0|2,0,0]=3 458 B9R1.34 ClC1=CC(Br)=CC(Cl)=N1 PI-37420 [0,1,0,0,0,0|3,0,0]=4 459 B9R1.34 Clc1cc(Br)cc(c1)Br PI-35806 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.34 Clc1cc(Br)cc(c1)I PI-36792 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.34 Clc1cc(Cl)cc(Br)c1 PI-11894 [0,1,0,0,0,0|2,0,0]=3 462 B9R1.34 Clc1cc(Cl)cc(I)c1 PI-30450 [0,1,0,0,0,0|2,0,0]=3 463 B9R1.34 Clc1cc(Cl)nc(n1)C PI-15334 [0,1,0,0,0,0|3,0,0]=4 464 B9R1.34 Clc1cc(N)nc(Cl)c1 PI-27094 [0,1,0,0,0,0|3,0,0]=4 465 B9R1.34 Fc1cc(Br)cc(I)c1 PI-21452 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.34 Fc1cc(F)cc(Cl)c1 PI-28147 [0,1,0,0,0,0|2,0,0]=3 467 B9R1.34 Fc1cc(F)cc(c1)Br PI-11897 [0,1,0,0,0,0|2,0,0]=3 468 B9R1.34 Fc1cc(F)nc(F)c1 PI-11018 [0,1,0,0,0,0|3,0,0]=4 469 B9R1.34 IC1=CC(Br)=CC(Br)=C1 PI-41778 [0,1,0,0,0,0|2,0,0]=3 470 B9R1.34 Ic1cc(C)nc(c1)F PI-39154 [0,1,0,0,0,0|2,0,0]=3 471 B9R1.34 NC1=CC(Br)=CC(Br)=C1 PI-41779 [0,1,0,0,0,0|2,0,0]=3 472 B9R1.34 NC1=CC(Cl)=CC(N)=C1 PI-30495 [0,1,0,0,0,0|2,0,0]=3 473 B9R1.34 NC1=CC(N)=CC(N)=C1 PI-39677 [0,1,0,0,0,0|2,0,0]=3 474 B9R1.34 Nc1cc(C)nc(c1)C PI-38724 [0,1,0,0,0,0|2,0,0]=3 475 B9R1.34 Nc1cc(O)nc(n1)N PI-15456 [0,1,0,0,0,0|3,0,0]=4 476 B9R1.34 O=c1cc(C)oc(C)c1 PI-29024 [0,1,0,0,0,0|1,0,1]=3 477 B9R1.34 Oc1cc(C)nc(c1)C PI-16037 [0,1,0,0,0,0|1,0,0]=2 478 B9R1.34 Oc1cc(Cl)cc(c1)Cl PI-37316 [0,1,0,0,0,0|1,0,0]=2 479 B9R1.34 Oc1cc(F)cc(Br)c1 PI-34268 [0,1,0,0,0,0|1,0,0]=2 480 B9R1.34 Oc1cc(F)cc(c1)Cl PI-38861 [0,1,0,0,0,0|1,0,0]=2 481 B9R1.34 Oc1cc(F)cc(c1)F PI-16915 [0,1,0,0,0,0|1,0,0]=2 482 B9R1.34 Oc1cc(O)cc(c1)O PI-16481 [0,1,0,0,0,0|1,0,0]=2 483 B9R1.34 Oc1cc(O)cc(c1)O PI-39326 [0,1,0,0,0,0|1,0,0]=2 484 B9R1.34 Oc1cc(O)nc(N)n1 PI-28001 [0,1,0,0,0,0|3,0,0]=4 485 B9R1.34 Oc1cc(O)nc(S)n1 PI-33477 [0,1,0,0,0,0|3,0,0]=4 486 B9R1.69 BrC1=CC(=C(C=C1)C)Cl PI-20673 [0,1,0,0,0,0|2,0,0]=3 487 B9R1.69 BrC1=CN=C(C(=C1)C)C PI-41495 [0,1,0,0,0,0|2,0,0]=3 488 B9R1.69 Brc1ccc(=O)n(C)c1 PI-35908 [0,1,0,0,0,0|2,0,0]=3 489 B9R1.69 Brc1ccc(N)c(Br)n1 PI-10325 [0,1,0,0,0,0|3,0,0]=4 490 B9R1.69 Brc1ccc(N)c(C)c1 PI-11003 [0,1,0,0,0,0|1,0,0]=2 491 B9R1.69 Brc1ccc(N)c(N)c1 PI-34413 [0,1,0,0,0,0|2,0,0]=3 492 B9R1.69 Brc1ccc(c(c1)Br)F PI-28149 [0,1,0,0,0,0|2,0,0]=3 493 B9R1.69 Brc1ccc(c(c1)C)I PI-21533 [0,1,0,0,0,0|1,0,0]=2 494 B9R1.69 Brc1ccc(c(c1)F)Br PI-20968 [0,1,0,0,0,0|2,0,0]=3 495 B9R1.69 Brc1ccc(c(c1)F)Cl PI-28679 [0,1,0,0,0,0|2,0,0]=3 496 B9R1.69 Brc1ccc(c(c1)F)F PI-10759 [0,1,0,0,0,0|2,0,0]=3 497 B9R1.69 Brc1ccc(c(c1)F)O PI-31106 [0,1,0,0,0,0|2,0,0]=3 498 B9R1.69 Brc1ccc(c(c1)N)F PI-21432 [0,1,0,0,0,0|2,0,0]=3 499 B9R1.69 Brc1ccc(c(c1)O)F PI-33069 [0,1,0,0,0,0|1,0,0]=2 500 B9R1.69 Brc1cnc(Br)c(C)c1 PI-16819 [0,1,0,0,0,0|2,0,0]=3 501 B9R1.69 Brc1cnc(c(c1)F)Br PI-36814 [0,1,0,0,0,0|3,0,0]=4 502 B9R1.69 Brc1cnc(c(c1)F)Cl PI-36963 [0,1,0,0,0,0|3,0,0]=4 503 B9R1.69 Brc1cnc(c(c1)F)N PI-36949 [0,1,0,0,0,0|3,0,0]=4 504 B9R1.69 Brc1ncc(N)c(C)c1 PI-20000 [0,1,0,0,0,0|2,0,0]=3 505 B9R1.69 C1=C(C(=CC=C1Br)O)C PI-22157 [0,1,0,0,0,0|1,0,0]=2 506 B9R1.69 C1=C(C(=CC=C1F)O)C PI-16986 [0,1,0,0,0,0|1,0,0]=2 507 B9R1.69 C1=C(C(=CN=C1Br)N)N PI-44067 [0,1,0,0,0,0|3,0,0]=4 508 B9R1.69 C1=C(C(=CN=C1Cl)Br)Cl PI-43244 [0,1,0,0,0,0|3,0,0]=4 509 B9R1.69 C1=C(C(=CN=C1Cl)F)I PI-34441 [0,1,0,0,0,0|3,0,0]=4 510 B9R1.69 C1=C(C(=CN=C1Cl)I)F PI-48142 [0,1,0,0,0,0|3,0,0]=4 511 B9R1.69 C1=C(C(=CN=C1Cl)I)N PI-50551 [0,1,0,0,0,0|3,0,0]=4 512 B9R1.69 C1=C(C(=CN=C1Cl)N)Cl PI-48149 [0,1,0,0,0,0|3,0,0]=4 513 B9R1.69 C1=C(C(=CN=C1Cl)O)N PI-43996 [0,1,0,0,0,0|3,0,0]=4 514 B9R1.69 C1=C(C(=CN=C1F)Cl)I PI-34438 [0,1,0,0,0,0|3,0,0]=4 515 B9R1.69 C1=C(C(=CN=C1N)Br)F PI-45767 [0,1,0,0,0,0|3,0,0]=4 516 B9R1.69 C1=C(C(=CNC1=O)Cl)O PI-33382 [0,1,0,0,0,0|2,0,0]=3 517 B9R1.69 C1=C(C(=O)NC=C1Br)Cl PI-38894 [0,1,0,0,0,0|3,0,0]=4 518 B9R1.69 C1=C(C(=O)NC=C1Br)O PI-46997 [0,1,0,0,0,0|2,0,0]=3 519 B9R1.69 C1=C(C(=O)NC=C1Cl)I PI-47309 [0,1,0,0,0,0|3,0,0]=4 520 B9R1.69 C1=C(C=NC(=C1Br)Br)Br PI-28803 [0,1,0,0,0,0|3,0,0]=4 521 B9R1.69 C1=C(C=NC(=C1Br)Cl)Br PI-10513 [0,1,0,0,0,0|3,0,0]=4 522 B9R1.69 C1=C(C=NC(=C1Br)F)Br PI-28562 [0,1,0,0,0,0|3,0,0]=4 523 B9R1.69 C1=C(C=NC(=C1Br)F)Cl PI-40457 [0,1,0,0,0,0|3,0,0]=4 524 B9R1.69 C1=C(C=NC(=C1Br)N)Br PI-16741 [0,1,0,0,0,0|3,0,0]=4 525 B9R1.69 C1=C(C=NC(=C1Cl)Cl)Cl PI-16732 [0,1,0,0,0,0|3,0,0]=4 526 B9R1.69 C1=C(C=NC(=C1Cl)N)Br PI-34981 [0,1,0,0,0,0|3,0,0]=4 527 B9R1.69 C1=C(C=NC(=C1Cl)N)Cl PI-16165 [0,1,0,0,0,0|3,0,0]=4 528 B9R1.69 C1=C(C=NC(=C1F)F)Cl PI-25958 [0,1,0,0,0,0|3,0,0]=4 529 B9R1.69 C1=C(C=NC(=C1I)Cl)F PI-32876 [0,1,0,0,0,0|3,0,0]=4 530 B9R1.69 C1=C(C=NC(=C1N)Br)Br PI-47236 [0,1,0,0,0,0|3,0,0]=4 531 B9R1.69 C1=C(C=NC(=C1N)Cl)Br PI-44963 [0,1,0,0,0,0|3,0,0]=4 532 B9R1.69 C1=C(C=NC(=C1N)Cl)Cl PI-47237 [0,1,0,0,0,0|3,0,0]=4 533 B9R1.69 C1=C(C=NC(=C1N)N)Br PI-33906 [0,1,0,0,0,0|3,0,0]=4 534 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl PI-21594 [0,1,0,0,0,0|2,0,0]=3 535 B9R1.69 C1=CC(=C(C=C1Br)Cl)I PI-20639 [0,1,0,0,0,0|2,0,0]=3 536 B9R1.69 C1=CC(=C(C=C1Br)Cl)N PI-20600 [0,1,0,0,0,0|2,0,0]=3 537 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-21433 [0,1,0,0,0,0|2,0,0]=3 538 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-32450 [0,1,0,0,0,0|2,0,0]=3 539 B9R1.69 C1=CC(=C(C=C1Br)N)O PI-33346 [0,1,0,0,0,0|2,0,0]=3 540 B9R1.69 C1=CC(=C(C=C1Br)O)Cl PI-32432 [0,1,0,0,0,0|1,0,0]=2 541 B9R1.69 C1=CC(=C(C=C1Cl)Br)O PI-33867 [0,1,0,0,0,0|2,0,0]=3 542 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br PI-21592 [0,1,0,0,0,0|2,0,0]=3 543 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F PI-16889 [0,1,0,0,0,0|2,0,0]=3 544 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S PI-21086 [0,1,0,0,0,0|2,0,0]=3 545 B9R1.69 C1=CC(=C(C=C1Cl)F)Cl PI-16933 [0,1,0,0,0,0|2,0,0]=3 546 B9R1.69 C1=CC(=C(C=C1Cl)F)I PI-20092 [0,1,0,0,0,0|2,0,0]=3 547 B9R1.69 C1=CC(=C(C=C1Cl)F)N PI-31238 [0,1,0,0,0,0|2,0,0]=3 548 B9R1.69 C1=CC(=C(C=C1Cl)F)O PI-28420 [0,1,0,0,0,0|2,0,0]=3 549 B9R1.69 C1=CC(=C(C=C1Cl)I)Cl PI-21046 [0,1,0,0,0,0|2,0,0]=3 550 B9R1.69 C1=CC(=C(C=C1Cl)N)F PI-28267 [0,1,0,0,0,0|2,0,0]=3 551 B9R1.69 C1=CC(=C(C=C1Cl)N)N PI-16272 [0,1,0,0,0,0|2,0,0]=3 552 B9R1.69 C1=CC(=C(C=C1Cl)O)Br PI-34266 [0,1,0,0,0,0|1,0,0]=2 553 B9R1.69 C1=CC(=C(C=C1Cl)O)N PI-11790 [0,1,0,0,0,0|1,0,0]=2 554 B9R1.69 C1=CC(=C(C=C1Cl)S)Cl PI-21357 [0,1,0,0,0,0|1,1,0]=3 555 B9R1.69 C1=CC(=C(C=C1F)Br)Br PI-20967 [0,1,0,0,0,0|2,0,0]=3 556 B9R1.69 C1=CC(=C(C=C1F)Br)Cl PI-20627 [0,1,0,0,0,0|2,0,0]=3 557 B9R1.69 C1=CC(=C(C=C1F)Br)F PI-28496 [0,1,0,0,0,0|2,0,0]=3 558 B9R1.69 C1=CC(=C(C=C1F)Br)N PI-16538 [0,1,0,0,0,0|2,0,0]=3 559 B9R1.69 C1=CC(=C(C=C1F)Cl)Br PI-20629 [0,1,0,0,0,0|2,0,0]=3 560 B9R1.69 C1=CC(=C(C=C1F)Cl)Cl PI-16890 [0,1,0,0,0,0|2,0,0]=3 561 B9R1.69 C1=CC(=C(C=C1F)Cl)O PI-16901 [0,1,0,0,0,0|2,0,0]=3 562 B9R1.69 C1=CC(=C(C=C1F)F)Cl PI-16888 [0,1,0,0,0,0|2,0,0]=3 563 B9R1.69 C1=CC(=C(C=C1F)F)O PI-16940 [0,1,0,0,0,0|2,0,0]=3 564 B9R1.69 C1=CC(=C(C=C1F)I)Br PI-14444 [0,1,0,0,0,0|2,0,0]=3 565 B9R1.69 C1=CC(=C(C=C1F)I)N PI-10294 [0,1,0,0,0,0|2,0,0]=3 566 B9R1.69 C1=CC(=C(C=C1F)N)Cl PI-28546 [0,1,0,0,0,0|2,0,0]=3 567 B9R1.69 C1=CC(=C(C=C1F)N)I PI-10621 [0,1,0,0,0,0|2,0,0]=3 568 B9R1.69 C1=CC(=C(C=C1F)N)N PI-30535 [0,1,0,0,0,0|2,0,0]=3 569 B9R1.69 C1=CC(=C(C=C1F)O)N PI-28627 [0,1,0,0,0,0|1,0,0]=2 570 B9R1.69 C1=CC(=C(C=C1I)Cl)Cl PI-30279 [0,1,0,0,0,0|2,0,0]=3 571 B9R1.69 C1=CC(=C(C=C1I)Cl)F PI-17308 [0,1,0,0,0,0|2,0,0]=3 572 B9R1.69 C1=CC(=C(C=C1I)Cl)N PI-12088 [0,1,0,0,0,0|2,0,0]=3 573 B9R1.69 C1=CC(=C(C=C1I)F)F PI-28714 [0,1,0,0,0,0|2,0,0]=3 574 B9R1.69 C1=CC(=C(C=C1I)F)N PI-16385 [0,1,0,0,0,0|2,0,0]=3 575 B9R1.69 C1=CC(=C(C=C1I)F)O PI-43132 [0,1,0,0,0,0|2,0,0]=3 576 B9R1.69 C1=CC(=C(C=C1N)Cl)F PI-15213 [0,1,0,0,0,0|2,0,0]=3 577 B9R1.69 C1=CC(=C(C=C1N)Cl)N PI-30776 [0,1,0,0,0,0|2,0,0]=3 578 B9R1.69 C1=CC(=C(C=C1N)F)Cl PI-28447 [0,1,0,0,0,0|2,0,0]=3 579 B9R1.69 C1=CC(=C(C=C1N)I)N PI-34733 [0,1,0,0,0,0|2,0,0]=3 580 B9R1.69 C1=CC(=C(C=C1N)N)F PI-28702 [0,1,0,0,0,0|2,0,0]=3 581 B9R1.69 C1=CC(=C(C=C1N)N)N PI-30777 [0,1,0,0,0,0|2,0,0]=3 582 B9R1.69 C1=CC(=C(C=C1O)Cl)F PI-16912 [0,1,0,0,0,0|1,0,0]=2 583 B9R1.69 C1=CC(=C(C=C1O)F)Cl PI-10651 [0,1,0,0,0,0|1,0,0]=2 584 B9R1.69 C1=CC(=C(C=C1O)F)N PI-16958 [0,1,0,0,0,0|1,0,0]=2 585 B9R1.69 C1=CC(=C(C=C1S)Cl)Cl PI-21087 [0,1,0,0,0,0|1,1,0]=3 586 B9R1.69 C1=CC(=C(C=C1S)Cl)F PI-20118 [0,1,0,0,0,0|1,1,0]=3 587 B9R1.69 C1=CC(=C(C=C1S)F)F PI-28680 [0,1,0,0,0,0|1,1,0]=3 588 B9R1.69 C1=CC(=C(C=C1S)S)Cl PI-11011 [0,1,0,0,0,0|1,1,0]=3 589 B9R1.69 C1=CC(=NC(=C1N)Cl)Cl PI-30798 [0,1,0,0,0,0|3,0,0]=4 590 B9R1.69 C1=CC(=NC(=C1N)N)Cl PI-32634 [0,1,0,0,0,0|3,0,0]=4 591 B9R1.69 C1=CC(=O)C(=CC1=O)Cl PI-17305 [0,1,0,0,0,0|1,0,1]=3 592 B9R1.69 C1=CC(=[N+](C=C1F)[O-])Br PI-42574 [0,1,0,0,0,0|2,0,1]=4 593 B9R1.69 C1=CC(=[N+](C=C1F)[O-])Cl PI-42567 [0,1,0,0,0,0|2,0,1]=4 594 B9R1.69 CC1=C(C=C(C=C1)Br)N PI-31358 [0,1,0,0,0,0|2,0,0]=3 595 B9R1.69 CC1=C(C=C(C=C1)Cl)Br PI-20668 [0,1,0,0,0,0|2,0,0]=3 596 B9R1.69 CC1=C(C=C(C=C1)Cl)F PI-16988 [0,1,0,0,0,0|2,0,0]=3 597 B9R1.69 CC1=C(C=C(C=C1)Cl)I PI-19456 [0,1,0,0,0,0|2,0,0]=3 598 B9R1.69 CC1=C(C=C(C=C1)Cl)O PI-28617 [0,1,0,0,0,0|1,0,0]=2 599 B9R1.69 CC1=C(C=C(C=C1)F)C PI-11592 [0,1,0,0,0,0|1,0,0]=2 600 B9R1.69 CC1=C(C=C(C=C1)F)Cl PI-28544 [0,1,0,0,0,0|2,0,0]=3 601 B9R1.69 CC1=C(C=C(C=C1)F)F PI-28545 [0,1,0,0,0,0|2,0,0]=3 602 B9R1.69 CC1=C(C=C(C=C1)F)I PI-10676 [0,1,0,0,0,0|2,0,0]=3 603 B9R1.69 CC1=C(C=C(C=C1)F)N PI-16382 [0,1,0,0,0,0|2,0,0]=3 604 B9R1.69 CC1=C(C=C(C=C1)I)F PI-10672 [0,1,0,0,0,0|2,0,0]=3 605 B9R1.69 CC1=C(C=C(C=C1)I)N PI-19927 [0,1,0,0,0,0|2,0,0]=3 606 B9R1.69 CC1=C(C=C(C=C1)N)Br PI-10966 [0,1,0,0,0,0|2,0,0]=3 607 B9R1.69 CC1=C(C=C(C=C1)N)Cl PI-34322 [0,1,0,0,0,0|2,0,0]=3 608 B9R1.69 CC1=C(C=C(C=C1)N)F PI-16383 [0,1,0,0,0,0|2,0,0]=3 609 B9R1.69 CC1=C(C=C(C=C1)N)I PI-19496 [0,1,0,0,0,0|2,0,0]=3 610 B9R1.69 CC1=C(C=C(C=C1)N)O PI-11314 [0,1,0,0,0,0|1,0,0]=2 611 B9R1.69 CC1=C(C=C(C=C1)O)N PI-11312 [0,1,0,0,0,0|1,0,0]=2 612 B9R1.69 CC1=C(C=C(C=C1)S)C PI-11009 [0,1,0,0,0,0|0,1,0]=2 613 B9R1.69 CC1=C(C=C(C=N1)Br)N PI-40246 [0,1,0,0,0,0|3,0,0]=4 614 B9R1.69 CC1=C(C=CC(=C1)Br)Cl PI-20675 [0,1,0,0,0,0|1,0,0]=2 615 B9R1.69 CC1=C(C=CC(=C1)Br)F PI-31216 [0,1,0,0,0,0|1,0,0]=2 616 B9R1.69 CC1=C(C=CC(=C1)Cl)F PI-28542 [0,1,0,0,0,0|1,0,0]=2 617 B9R1.69 CC1=C(C=CC(=C1)Cl)N PI-34323 [0,1,0,0,0,0|1,0,0]=2 618 B9R1.69 CC1=C(C=CC(=C1)Cl)O PI-11333 [0,1,0,0,0,0|1,0,0]=2 619 B9R1.69 CC1=C(C=CC(=C1)F)Br PI-16983 [0,1,0,0,0,0|1,0,0]=2 620 B9R1.69 CC1=C(C=CC(=C1)F)Cl PI-16931 [0,1,0,0,0,0|1,0,0]=2 621 B9R1.69 CC1=C(C=CC(=C1)F)F PI-28543 [0,1,0,0,0,0|1,0,0]=2 622 B9R1.69 CC1=C(C=CC(=C1)F)I PI-10678 [0,1,0,0,0,0|1,0,0]=2 623 B9R1.69 CC1=C(C=CC(=C1)F)N PI-16985 [0,1,0,0,0,0|1,0,0]=2 624 B9R1.69 CC1=C(C=CC(=C1)I)Cl PI-19072 [0,1,0,0,0,0|1,0,0]=2 625 B9R1.69 CC1=C(C=CC(=C1)I)F PI-10673 [0,1,0,0,0,0|1,0,0]=2 626 B9R1.69 CC1=C(C=CC(=C1)I)N PI-30113 [0,1,0,0,0,0|1,0,0]=2 627 B9R1.69 CC1=C(C=CC(=C1)N)Cl PI-24577 [0,1,0,0,0,0|1,0,0]=2 628 B9R1.69 CC1=C(C=CC(=C1)N)F PI-16984 [0,1,0,0,0,0|1,0,0]=2 629 B9R1.69 CC1=C(C=CC(=C1)N)O PI-10082 [0,1,0,0,0,0|1,0,0]=2 630 B9R1.69 CC1=C(C=CC(=C1)O)F PI-10655 [0,1,0,0,0,0|0,0,0]=1 631 B9R1.69 CC1=C(C=CC(=C1)O)N PI-11473 [0,1,0,0,0,0|0,0,0]=1 632 B9R1.69 CC1=C(C=CC(=C1)S)F PI-23789 [0,1,0,0,0,0|0,1,0]=2 633 B9R1.69 CC1=C(C=CC(=N1)Br)Br PI-34456 [0,1,0,0,0,0|2,0,0]=3 634 B9R1.69 CC1=C(C=CC(=N1)Br)F PI-10396 [0,1,0,0,0,0|2,0,0]=3 635 B9R1.69 CC1=C(C=CC(=N1)Br)N PI-34984 [0,1,0,0,0,0|2,0,0]=3 636 B9R1.69 CC1=C(C=CC(=N1)Cl)F PI-34442 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.69 CC1=C(C=CC(=N1)F)Br PI-35833 [0,1,0,0,0,0|2,0,0]=3 638 B9R1.69 CC1=C(C=CC(=N1)F)N PI-32879 [0,1,0,0,0,0|2,0,0]=3 639 B9R1.69 CC1=C(C=CC(=N1)N)Br PI-10444 [0,1,0,0,0,0|2,0,0]=3 640 B9R1.69 CC1=C(C=CC(=N1)N)Cl PI-34982 [0,1,0,0,0,0|2,0,0]=3 641 B9R1.69 CC1=C(N=C(C=C1)N)Cl PI-39853 [0,1,0,0,0,0|3,0,0]=4 642 B9R1.69 CC1=CC(=C(C=C1)Br)Cl PI-20674 [0,1,0,0,0,0|1,0,0]=2 643 B9R1.69 CC1=CC(=C(C=C1)C)O PI-33176 [0,1,0,0,0,0|0,0,0]=1 644 B9R1.69 CC1=CC(=C(C=C1)C)S PI-21355 [0,1,0,0,0,0|0,1,0]=2 645 B9R1.69 CC1=CC(=C(C=C1)Cl)Br PI-20672 [0,1,0,0,0,0|1,0,0]=2 646 B9R1.69 CC1=CC(=C(C=C1)Cl)C PI-24680 [0,1,0,0,0,0|1,0,0]=2 647 B9R1.69 CC1=CC(=C(C=C1)Cl)F PI-10669 [0,1,0,0,0,0|1,0,0]=2 648 B9R1.69 CC1=CC(=C(C=C1)Cl)N PI-17325 [0,1,0,0,0,0|1,0,0]=2 649 B9R1.69 CC1=CC(=C(C=C1)Cl)O PI-42096 [0,1,0,0,0,0|0,0,0]=1 650 B9R1.69 CC1=CC(=C(C=C1)F)Cl PI-10668 [0,1,0,0,0,0|1,0,0]=2 651 B9R1.69 CC1=CC(=C(C=C1)F)F PI-16918 [0,1,0,0,0,0|1,0,0]=2 652 B9R1.69 CC1=CC(=C(C=C1)F)I PI-10677 [0,1,0,0,0,0|1,0,0]=2 653 B9R1.69 CC1=CC(=C(C=C1)F)N PI-16989 [0,1,0,0,0,0|1,0,0]=2 654 B9R1.69 CC1=CC(=C(C=C1)F)O PI-10653 [0,1,0,0,0,0|0,0,0]=1 655 B9R1.69 CC1=CC(=C(C=C1)I)Br PI-21532 [0,1,0,0,0,0|1,0,0]=2 656 B9R1.69 CC1=CC(=C(C=C1)I)Cl PI-19073 [0,1,0,0,0,0|1,0,0]=2 657 B9R1.69 CC1=CC(=C(C=C1)I)F PI-10675 [0,1,0,0,0,0|1,0,0]=2 658 B9R1.69 CC1=CC(=C(C=C1)I)I PI-19174 [0,1,0,0,0,0|1,0,0]=2 659 B9R1.69 CC1=CC(=C(C=C1)N)C PI-27338 [0,1,0,0,0,0|1,0,0]=2 660 B9R1.69 CC1=CC(=C(C=C1)N)Cl PI-20150 [0,1,0,0,0,0|1,0,0]=2 661 B9R1.69 CC1=CC(=C(C=C1)N)O PI-28344 [0,1,0,0,0,0|0,0,0]=1 662 B9R1.69 CC1=CC(=C(C=C1)N)S PI-41435 [0,1,0,0,0,0|0,1,0]=2 663 B9R1.69 CC1=CC(=C(C=C1)O)Cl PI-19823 [0,1,0,0,0,0|1,0,0]=2 664 B9R1.69 CC1=CC(=C(C=C1)O)N PI-44624 [0,1,0,0,0,0|1,0,0]=2 665 B9R1.69 CC1=CC(=C(C=C1)S)C PI-21999 [0,1,0,0,0,0|1,0,0]=2 666 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30102 [0,1,0,0,0,0|0,1,0]=2 667 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30441 [0,1,0,0,0,0|0,1,0]=2 668 B9R1.69 CC1=CC(=C(N=C1)C)C PI-16692 [0,1,0,0,0,0|2,0,0]=3 669 B9R1.69 CC1=CC(=C(N=C1)Cl)F PI-16765 [0,1,0,0,0,0|2,0,0]=3 670 B9R1.69 CC1=CC(=C(N=C1)Cl)N PI-30504 [0,1,0,0,0,0|2,0,0]=3 671 B9R1.69 CC1=CC(=C(N=C1)F)Br PI-34448 [0,1,0,0,0,0|2,0,0]=3 672 B9R1.69 CC1=CC(=C(N=C1)N)Br PI-24152 [0,1,0,0,0,0|2,0,0]=3 673 B9R1.69 CC1=CC(=CN=C1Br)N PI-27538 [0,1,0,0,0,0|2,0,0]=3 674 B9R1.69 CC1=CC(=CN=C1Cl)Br PI-24299 [0,1,0,0,0,0|2,0,0]=3 675 B9R1.69 CC1=CC(=CN=C1Cl)F PI-32877 [0,1,0,0,0,0|2,0,0]=3 676 B9R1.69 CC1=CC(=CN=C1Cl)N PI-34979 [0,1,0,0,0,0|2,0,0]=3 677 B9R1.69 CC1=CC(=CN=C1F)Br PI-32872 [0,1,0,0,0,0|2,0,0]=3 678 B9R1.69 CC1=CC(=CN=C1F)N PI-32878 [0,1,0,0,0,0|2,0,0]=3 679 B9R1.69 CC1=CC(=CN=C1N)Br PI-25459 [0,1,0,0,0,0|2,0,0]=3 680 B9R1.69 CC1=CC(=NC=C1Br)Br PI-39259 [0,1,0,0,0,0|2,0,0]=3 681 B9R1.69 CC1=CC(=NC=C1N)Cl PI-30838 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.69 CC1=CC(=NN=C1Cl)Cl PI-41115 [0,1,0,0,0,0|3,0,0]=4 683 B9R1.69 CC1=CC(=NN=C1Cl)N PI-43264 [0,1,0,0,0,0|3,0,0]=4 684 B9R1.69 CC1=CC(=O)NNC1=O PI-44271 [0,1,0,0,0,0|2,0,1]=4 685 B9R1.69 CC1=CC(N)=NC=C1B PI-30996 [0,1,0,0,0,0|2,0,0]=3 686 B9R1.69 CC1=CC(N)=NC=C1Cl PI-31795 [0,1,0,0,0,0|2,0,0]=3 687 B9R1.69 CC1=CC=C(F)C(Br)=N1 PI-40471 [0,1,0,0,0,0|2,0,0]=3 688 B9R1.69 CC1=CN=C(C(=N1)C)C PI-11726 [0,1,0,0,0,0|3,0,0]=4 689 B9R1.69 CC1=CN=C(Cl)C(C)=N1 PI-38217 [0,1,0,0,0,0|3,0,0]=4 690 B9R1.69 CC1=NC(=C(C=C1)Br)Cl PI-44133 [0,1,0,0,0,0|2,0,0]=3 691 B9R1.69 CC1=NC(=C(C=C1)Br)N PI-30104 [0,1,0,0,0,0|2,0,0]=3 692 B9R1.69 CC1=NC(=C(C=C1)I)F PI-34430 [0,1,0,0,0,0|2,0,0]=3 693 B9R1.69 CC1=NC(=C(C=C1)N)Br PI-27124 [0,1,0,0,0,0|2,0,0]=3 694 B9R1.69 CC1=NC(=C(C=C1)N)C PI-16694 [0,1,0,0,0,0|2,0,0]=3 695 B9R1.69 CC1=NC(=C(C=C1)N)C PI-33783 [0,1,0,0,0,0|2,0,0]=3 696 B9R1.69 CC1=NC(=C(C=C1)N)F PI-24368 [0,1,0,0,0,0|2,0,0]=3 697 B9R1.69 CC1=NC(=C(C=C1)O)C PI-21953 [0,1,0,0,0,0|2,0,0]=3 698 B9R1.69 CC1=NC(=NC=C1N)C PI-32946 [0,1,0,0,0,0|3,0,0]=4 699 B9R1.69 CC1=NC(=NC=C1N)Cl PI-45749 [0,1,0,0,0,0|3,0,0]=4 700 B9R1.69 CC1=NC(Cl)=NC=C1Br PI-46752 [0,1,0,0,0,0|3,0,0]=4 701 B9R1.69 CC1=NC(Cl)=NC=C1Cl PI-46723 [0,1,0,0,0,0|3,0,0]=4 702 B9R1.69 CC1=NC=C(C(=O)N1)I PI-47320 [0,1,0,0,0,0|2,0,1]=4 703 B9R1.69 CC1=[N+](C=C(C=C1)Br)[O-] PI-34301 [0,1,0,0,0,0|2,0,1]=4 704 B9R1.69 CN1C=CC(=CC1=O)Br PI-40242 [0,1,0,0,0,0|2,0,1]=4 705 B9R1.69 Cc1ccc(Br)cc1F PI-31215 [0,1,0,0,0,0|2,0,0]=3 706 B9R1.69 Cc1ccc(I)c(N)c1 PI-13704 [0,1,0,0,0,0|1,0,0]=2 707 B9R1.69 Cc1ccc(N)c(Br)c1 PI-21582 [0,1,0,0,0,0|1,0,0]=2 708 B9R1.69 Cc1ccc(c(c1)Br)F PI-28541 [0,1,0,0,0,0|1,0,0]=2 709 B9R1.69 Cc1ccc(c(c1)C)Br PI-38906 [0,1,0,0,0,0|1,0,0]=2 710 B9R1.69 Cc1ccc(c(c1)F)Br PI-16987 [0,1,0,0,0,0|1,0,0]=2 711 B9R1.69 Cc1ccc(c(c1)F)N PI-16381 [0,1,0,0,0,0|1,0,0]=2 712 B9R1.69 Cc1ccc(c(c1)N)Br PI-32614 [0,1,0,0,0,0|1,0,0]=2 713 B9R1.69 Cc1ccc(c(c1)N)N PI-33398 [0,1,0,0,0,0|1,0,0]=2 714 B9R1.69 Cc1ccc(c(c1)O)O PI-11188 [0,1,0,0,0,0|0,0,0]=1 715 B9R1.69 Cc1ccc(c(n1)C)Br PI-14419 [0,1,0,0,0,0|2,0,0]=3 716 B9R1.69 Cc1ccc(c(n1)Cl)N PI-30570 [0,1,0,0,0,0|2,0,0]=3 717 B9R1.69 Cc1cnc(Br)c(F)c1 PI-34446 [0,1,0,0,0,0|2,0,0]=3 718 B9R1.69 Cc1cnc(C)c(Cl)n1 PI-29990 [0,1,0,0,0,0|3,0,0]=4 719 B9R1.69 Cc1cnc(c(c1)I)F PI-32874 [0,1,0,0,0,0|2,0,0]=3 720 B9R1.69 Cc1ncc(c(c1)C)N PI-38589 [0,1,0,0,0,0|2,0,0]=3 721 B9R1.69 ClC1=CC(=C(C=C1)F)O PI-10650 [0,1,0,0,0,0|1,0,0]=2 722 B9R1.69 ClC1=CC(I)=CC=C1Br PI-41927 [0,1,0,0,0,0|2,0,0]=3 723 B9R1.69 ClC1=NC=C(Br)C(N)=C1 PI-39470 [0,1,0,0,0,0|3,0,0]=4 724 B9R1.69 Clc1ccc(c(c1)Br)Cl PI-21593 [0,1,0,0,0,0|2,0,0]=3 725 B9R1.69 Clc1ccc(c(c1)Br)F PI-20628 [0,1,0,0,0,0|2,0,0]=3 726 B9R1.69 Clc1ccc(c(c1)Br)I PI-38902 [0,1,0,0,0,0|2,0,0]=3 727 B9R1.69 Clc1ccc(c(c1)Br)N PI-21370 [0,1,0,0,0,0|2,0,0]=3 728 B9R1.69 Clc1ccc(c(c1)C)Br PI-20669 [0,1,0,0,0,0|1,0,0]=2 729 B9R1.69 Clc1ccc(c(c1)C)C PI-11593 [0,1,0,0,0,0|1,0,0]=2 730 B9R1.69 Clc1ccc(c(c1)C)I PI-30351 [0,1,0,0,0,0|1,0,0]=2 731 B9R1.69 Clc1ccc(c(c1)F)Br PI-20626 [0,1,0,0,0,0|2,0,0]=3 732 B9R1.69 Clc1ccc(c(c1)F)F PI-12302 [0,1,0,0,0,0|2,0,0]=3 733 B9R1.69 Clc1ccc(c(c1)N)S PI-14245 [0,1,0,0,0,0|2,0,0]=3 734 B9R1.69 Clc1ccc(c(c1)O)O PI-11978 [0,1,0,0,0,0|1,0,0]=2 735 B9R1.69 Clc1ccc(c(n1)C)N PI-38623 [0,1,0,0,0,0|2,0,0]=3 736 B9R1.69 Clc1ccc(c(n1)Cl)F PI-36904 [0,1,0,0,0,0|3,0,0]=4 737 B9R1.69 Clc1ccc(c(n1)Cl)I PI-10338 [0,1,0,0,0,0|3,0,0]=4 738 B9R1.69 Clc1cnc(Br)c(C)c1 PI-35935 [0,1,0,0,0,0|2,0,0]=3 739 B9R1.69 Clc1cnc(Br)c(Cl)c1 PI-16039 [0,1,0,0,0,0|3,0,0]=4 740 B9R1.69 Clc1cnc(c(c1)F)N PI-36849 [0,1,0,0,0,0|3,0,0]=4 741 B9R1.69 Clc1cnc(c(c1)I)N PI-38332 [0,1,0,0,0,0|3,0,0]=4 742 B9R1.69 Clc1ncc(c(c1)C)Br PI-38910 [0,1,0,0,0,0|2,0,0]=3 743 B9R1.69 Fc1ccc(C)c(S)c1 PI-23790 [0,1,0,0,0,0|1,1,0]=3 744 B9R1.69 Fc1ccc(I)c(Br)c1 PI-14445 [0,1,0,0,0,0|2,0,0]=3 745 B9R1.69 Fc1ccc(N)c(F)c1 PI-15215 [0,1,0,0,0,0|2,0,0]=3 746 B9R1.69 Fc1ccc(S)c(C)c1 PI-23788 [0,1,0,0,0,0|1,0,0]=2 747 B9R1.69 Fc1ccc(c(c1)Br)C PI-16886 [0,1,0,0,0,0|2,0,0]=3 748 B9R1.69 Fc1ccc(c(c1)Br)O PI-21470 [0,1,0,0,0,0|2,0,0]=3 749 B9R1.69 Fc1ccc(c(c1)Cl)F PI-28303 [0,1,0,0,0,0|2,0,0]=3 750 B9R1.69 Fc1ccc(c(c1)Cl)S PI-20117 [0,1,0,0,0,0|2,0,0]=3 751 B9R1.69 Fc1ccc(c(c1)F)Br PI-32222 [0,1,0,0,0,0|2,0,0]=3 752 B9R1.69 Fc1ccc(c(c1)F)F PI-10729 [0,1,0,0,0,0|2,0,0]=3 753 B9R1.69 Fc1ccc(c(c1)F)S PI-16902 [0,1,0,0,0,0|2,0,0]=3 754 B9R1.69 Fc1ccc(c(c1)N)Br PI-10617 [0,1,0,0,0,0|2,0,0]=3 755 B9R1.69 Fc1ccc(c(c1)N)F PI-16941 [0,1,0,0,0,0|2,0,0]=3 756 B9R1.69 Fc1ccc(c(c1)N)O PI-15926 [0,1,0,0,0,0|2,0,0]=3 757 B9R1.69 Fc1ccc(c(c1)O)Br PI-31067 [0,1,0,0,0,0|1,0,0]=2 758 B9R1.69 Fc1ccc(c(c1)O)C PI-10656 [0,1,0,0,0,0|1,0,0]=2 759 B9R1.69 Fc1ccc(c(c1)O)Cl PI-10649 [0,1,0,0,0,0|1,0,0]=2 760 B9R1.69 Fc1ccc(c(c1)O)F PI-16913 [0,1,0,0,0,0|1,0,0]=2 761 B9R1.69 Fc1ccc(c(c1)O)O PI-16942 [0,1,0,0,0,0|1,0,0]=2 762 B9R1.69 Fc1cnc(N)c(Br)c1 PI-32880 [0,1,0,0,0,0|3,0,0]=4 763 B9R1.69 Fc1cnc(c(c1)C)Br PI-34447 [0,1,0,0,0,0|2,0,0]=3 764 B9R1.69 Fc1cnc(c(c1)F)F PI-33059 [0,1,0,0,0,0|3,0,0]=4 765 B9R1.69 Fc1ncc(C)c(I)c1 PI-34432 [0,1,0,0,0,0|3,0,0]=4 766 B9R1.69 Fc1ncc(c(c1)C)Br PI-38328 [0,1,0,0,0,0|2,0,0]=3 767 B9R1.69 IC1=CC(Br)=CN=C1N PI-46623 [0,1,0,0,0,0|3,0,0]=4 768 B9R1.69 IC1=CC(O)=C(Cl)C=C1 PI-46497 [0,1,0,0,0,0|1,0,0]=2 769 B9R1.69 IC1=CC=C(Br)C(Br)=C1 PI-41928 [0,1,0,0,0,0|2,0,0]=3 770 B9R1.69 IC1=CC=C(Br)C=C1F PI-21451 [0,1,0,0,0,0|2,0,0]=3 771 B9R1.69 IC1=CC=C(F)C=C1F PI-28291 [0,1,0,0,0,0|2,0,0]=3 772 B9R1.69 Ic1ccc(Br)c(C)c1 PI-21531 [0,1,0,0,0,0|1,0,0]=2 773 B9R1.69 Ic1ccc(F)c(Br)c1 PI-21453 [0,1,0,0,0,0|2,0,0]=3 774 B9R1.69 Ic1ccc(c(c1)F)Br PI-14443 [0,1,0,0,0,0|2,0,0]=3 775 B9R1.69 NC1=C(Cl)C=C(O)C=C1 PI-39809 [0,1,0,0,0,0|1,0,0]=2 776 B9R1.69 NC1=CC(Br)=CC=C1Cl PI-20602 [0,1,0,0,0,0|2,0,0]=3 777 B9R1.69 NC1=CC=C(Br)C=C1I PI-39519 [0,1,0,0,0,0|2,0,0]=3 778 B9R1.69 NC1=CC=C(Cl)C(N)=C1 PI-11322 [0,1,0,0,0,0|2,0,0]=3 779 B9R1.69 NC1=NC(Br)=C(C)C=C1 PI-39854 [0,1,0,0,0,0|3,0,0]=4 780 B9R1.69 NC1=NC(N)=CC=C1Br PI-46757 [0,1,0,0,0,0|3,0,0]=4 781 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 PI-42591 [0,1,0,0,0,0|3,0,0]=4 782 B9R1.69 Nc1ccc(Br)c(C)c1 PI-21584 [0,1,0,0,0,0|1,0,0]=2 783 B9R1.69 Nc1ccc(C)c(O)c1 PI-11313 [0,1,0,0,0,0|1,0,0]=2 784 B9R1.69 Nc1ccc(F)c(C)n1 PI-34452 [0,1,0,0,0,0|2,0,0]=3 785 B9R1.69 Nc1ccc(O)c(Cl)c1 PI-11818 [0,1,0,0,0,0|2,0,0]=3 786 B9R1.69 Nc1ccc(O)c(F)c1 PI-28497 [0,1,0,0,0,0|2,0,0]=3 787 B9R1.69 Nc1ccc(c(c1)Br)F PI-12304 [0,1,0,0,0,0|2,0,0]=3 788 B9R1.69 Nc1ccc(c(c1)C)N PI-19993 [0,1,0,0,0,0|1,0,0]=2 789 B9R1.69 Nc1ccc(c(c1)Cl)Br PI-20601 [0,1,0,0,0,0|2,0,0]=3 790 B9R1.69 Nc1ccc(c(c1)Cl)I PI-30125 [0,1,0,0,0,0|2,0,0]=3 791 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38011 [0,1,0,0,0,0|2,0,0]=3 792 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38070 [0,1,0,0,0,0|2,0,0]=3 793 B9R1.69 Nc1ccc(c(c1)F)Br PI-10618 [0,1,0,0,0,0|2,0,0]=3 794 B9R1.69 Nc1ccc(c(c1)F)I PI-10620 [0,1,0,0,0,0|2,0,0]=3 795 B9R1.69 O=C1C=CC(N)=CN1C PI-46613 [0,1,0,0,0,0|2,0,0]=3 796 B9R1.69 OC1=CC(Cl)=CC=C1I PI-40949 [0,1,0,0,0,0|1,0,0]=2 797 B9R1.69 OC1=CC=C(Br)C=C1O PI-37116 [0,1,0,0,0,0|1,0,0]=2 798 B9R1.69 OC1=CC=C(C)C=C1Br PI-14476 [0,1,0,0,0,0|1,0,0]=2 799 B9R1.69 OC1=CC=C(N)C(Cl)=C1 PI-42395 [0,1,0,0,0,0|1,0,0]=2 800 B9R1.69 OC1=CC=C(N)C=C1N PI-32464 [0,1,0,0,0,0|2,0,0]=3 801 B9R1.69 Oc1cc(Cl)ccc1Cl PI-34659 [0,1,0,0,0,0|1,0,0]=2 802 B9R1.69 Oc1ccc(Br)c(F)c1 PI-10426 [0,1,0,0,0,0|1,0,0]=2 803 B9R1.69 Oc1ccc(Br)c(O)c1 PI-28737 [0,1,0,0,0,0|1,0,0]=2 804 B9R1.69 Oc1ccc(C)c(C)c1 PI-34164 [0,1,0,0,0,0|0,0,0]=1 805 B9R1.69 Oc1ccc(C)c(F)c1 PI-10654 [0,1,0,0,0,0|1,0,0]=2 806 B9R1.69 Oc1ccc(F)c(N)c1 PI-33926 [0,1,0,0,0,0|1,0,0]=2 807 B9R1.69 Oc1ccc(c(c1)Br)Cl PI-39217 [0,1,0,0,0,0|1,0,0]=2 808 B9R1.69 Oc1ccc(c(c1)Br)F PI-10647 [0,1,0,0,0,0|1,0,0]=2 809 B9R1.69 Oc1ccc(c(c1)C)Br PI-14477 [0,1,0,0,0,0|0,0,0]=1 810 B9R1.69 Oc1ccc(c(c1)F)F PI-16914 [0,1,0,0,0,0|1,0,0]=2 811 B9R1.69 Oc1ccc(c(c1)O)C PI-19649 [0,1,0,0,0,0|1,0,0]=2 812 B9R1.69 Oc1ccc(c(c1)O)F PI-10442 [0,1,0,0,0,0|1,0,0]=2 813 B9R1.69 Oc1ccc(c(c1)O)O PI-31220 [0,1,0,0,0,0|1,0,0]=2 814 B9R1.69 Oc1cnc(c(c1)Br)Cl PI-39120 [0,1,0,0,0,0|2,0,0]=3 815 B9R1.69 Oc1ncc(c(c1)Br)F PI-38921 [0,1,0,0,0,0|2,0,0]=3 816 B9R1.69 Sc1ccc(C)c(F)c1 PI-23787 [0,1,0,0,0,0|1,1,0]=3 817 B9R1.69 Sc1ccc(c(c1)C)O PI-18459 [0,1,0,0,0,0|0,1,0]=2 818 B7R0.4 CC=CC=CC(=O)[O-] PI-15818 [0,0,1,0,0,0|1,0,1]=3 819 B7R0.4 CCO\C=C\C(=O)O PI-41236 [0,0,1,0,0,0|2,0,1]=4 820 B7R0.7 CC=CC(=O)OC=C PI-13581 [0,0,1,0,0,0|1,0,1]=3 821 B7R1.2 Brc1c[nH]c(n1)C PI-14475 [0,0,0,0,1,0|3,0,0]=4 822 B7R1.2 Brc1ccc(Br)o1 PI-17239 [0,0,0,0,1,0|3,0,0]=4 823 B7R1.2 C1=C(Br)SC(=C1)Br PI-11156 [0,0,0,0,1,0|3,0,0]=4 824 B7R1.2 C1=C(N=C(S1)N)O PI-45401 [0,0,0,0,1,0|3,0,0]=4 825 B7R1.2 C1=C(SC(=C1)Br)Cl PI-20666 [0,0,0,0,1,0|3,0,0]=4 826 B7R1.2 C1=C(SC(=C1)Br)N PI-45449 [0,0,0,0,1,0|3,0,0]=4 827 B7R1.2 C1=C(SC(=C1)Cl)Cl PI-11157 [0,0,0,0,1,0|3,0,0]=4 828 B7R1.2 C1=C(SC(=C1)I)I PI-21280 [0,0,0,0,1,0|3,0,0]=4 829 B7R1.2 C1=C(SC=C1Br)Br PI-26554 [0,0,0,0,1,0|3,0,0]=4 830 B7R1.2 C1C(C=CC1=O)O PI-48068 [0,0,0,0,1,0|1,0,2]=4 831 B7R1.2 CC1=CC(=CS1)Br PI-22178 [0,0,0,0,1,0|2,0,0]=3 832 B7R1.2 CC1=CC(=NO1)C PI-11253 [0,0,0,0,1,0|3,0,0]=4 833 B7R1.2 CC1=CC(=O)N=N1 PI-30060 [0,0,0,0,1,0|2,0,1]=4 834 B7R1.2 CC1=CC=C(O1)C PI-44542 [0,0,0,0,1,0|2,0,0]=3 835 B7R1.2 CC1=CC=C(S1)Br PI-11164 [0,0,0,0,1,0|2,0,0]=3 836 B7R1.2 CC1=CC=C(S1)C PI-11158 [0,0,0,0,1,0|2,0,0]=3 837 B7R1.2 CC1=CN=C(S1)Br PI-45050 [0,0,0,0,1,0|3,0,0]=4 838 B7R1.2 CC1=CN=C(S1)C PI-11134 [0,0,0,0,1,0|3,0,0]=4 839 B7R1.2 CC1=CN=C(S1)Cl PI-11122 [0,0,0,0,1,0|3,0,0]=4 840 B7R1.2 CC1=CNC(=O)N1 PI-31820 [0,0,0,0,1,0|2,0,1]=4 841 B7R1.2 CC1=CSC(=N1)Br PI-40542 [0,0,0,0,1,0|3,0,0]=4 842 B7R1.2 CC1=CSC(=N1)C PI-11115 [0,0,0,0,1,0|3,0,0]=4 843 B7R1.2 CC1=CSC(=S)N1 PI-30630 [0,0,0,0,1,0|2,1,0]=4 844 B7R1.2 CC1=CSC(Cl)=N1 PI-40543 [0,0,0,0,1,0|3,0,0]=4 845 B7R1.2 CC1=NC=C(N1)I PI-45234 [0,0,0,0,1,0|3,0,0]=4 846 B7R1.2 CC1=NC=C(S1)Br PI-44984 [0,0,0,0,1,0|3,0,0]=4 847 B7R1.2 CN1C=C(C=N1)Br PI-34811 [0,0,0,0,1,0|3,0,0]=4 848 B7R1.2 CN1C=C(C=N1)Cl PI-34753 [0,0,0,0,1,0|3,0,0]=4 849 B7R1.2 CN1C=C(C=N1)I PI-31346 [0,0,0,0,1,0|3,0,0]=4 850 B7R1.2 Cc1[nH][nH]c(=O)c1 PI-10806 [0,0,0,0,1,0|2,0,1]=4 851 B7R1.2 Cc1[nH]cc(c1)C PI-10987 [0,0,0,0,1,0|2,0,0]=3 852 B7R1.2 Cc1[nH]cc(n1)C PI-31821 [0,0,0,0,1,0|3,0,0]=4 853 B7R1.2 Cc1[nH]nc(C)c1 PI-31342 [0,0,0,0,1,0|3,0,0]=4 854 B7R1.2 Cc1ccc(s1)Cl PI-29205 [0,0,0,0,1,0|2,0,0]=3 855 B7R1.2 Cc1ccn(n1)C PI-37587 [0,0,0,0,1,0|3,0,0]=4 856 B7R1.2 Cc1cnc(s1)N PI-31294 [0,0,0,0,1,0|3,0,0]=4 857 B7R1.2 Cc1csc(n1)N PI-31078 [0,0,0,0,1,0|3,0,0]=4 858 B7R1.2 Cc1noc(c1)N PI-30153 [0,0,0,0,1,0|3,0,0]=4 859 B7R1.2 Cc1nsc(N)c1 PI-25640 [0,0,0,0,1,0|3,0,0]=4 860 B7R1.2 Cc1scc(c1)C PI-29816 [0,0,0,0,1,0|2,0,0]=3 861 B7R1.2 Cn1cc(nc1)I PI-25810 [0,0,0,0,1,0|3,0,0]=4 862 B7R1.2 Cn1cc[n+](c1)C PI-38784 [0,0,0,0,1,0|3,0,0]=4 863 B7R1.2 Cn1ccc(I)n1 PI-37412 [0,0,0,0,1,0|3,0,0]=4 864 B7R1.2 Cn1ccc(n1)Br PI-38258 [0,0,0,0,1,0|3,0,0]=4 865 B7R1.2 Cn1ccc(n1)N PI-38170 [0,0,0,0,1,0|3,0,0]=4 866 B7R1.2 NC1=NC=C(C)N1 PI-40524 [0,0,0,0,1,0|3,0,0]=4 867 B7R1.2 Nc1noc(c1)C PI-33190 [0,0,0,0,1,0|3,0,0]=4 868 B7R1.2 O=C1C=CC(=O)N1 PI-29681 [0,0,0,0,1,0|2,0,1]=4 869 B7R1.4 Brc1cocc1Br PI-19445 [0,0,0,0,1,0|3,0,0]=4 870 B7R1.4 Brc1cscc1Br PI-10758 [0,0,0,0,1,0|3,0,0]=4 871 B7R1.4 Brc1cscc1C PI-39112 [0,0,0,0,1,0|2,0,0]=3 872 B7R1.4 Brc1sccc1Br PI-11154 [0,0,0,0,1,0|3,0,0]=4 873 B7R1.4 C1=C(C(=CN1)F)F PI-49257 [0,0,0,0,1,0|3,0,0]=4 874 B7R1.4 C1=C(C(=CS1)F)F PI-49324 [0,0,0,0,1,0|3,0,0]=4 875 B7R1.4 C1=C(C(=CS1)N)N PI-45454 [0,0,0,0,1,0|3,0,0]=4 876 B7R1.4 C1=COC(=C1Br)Br PI-17204 [0,0,0,0,1,0|3,0,0]=4 877 B7R1.4 C1=CSC(=C1Br)Cl PI-11159 [0,0,0,0,1,0|3,0,0]=4 878 B7R1.4 CC1=C(Br)NC=N1 PI-39631 [0,0,0,0,1,0|3,0,0]=4 879 B7R1.4 CC1=C(OC=N1)C PI-35004 [0,0,0,0,1,0|3,0,0]=4 880 B7R1.4 CC1=C(SC=C1)Cl PI-10992 [0,0,0,0,1,0|2,0,0]=3 881 B7R1.4 CC1=C(SC=N1)Br PI-50077 [0,0,0,0,1,0|3,0,0]=4 882 B7R1.4 CC1=C(SC=N1)C PI-11140 [0,0,0,0,1,0|3,0,0]=4 883 B7R1.4 CC1=CCOC1=O PI-46986 [0,0,0,0,1,0|1,0,2]=4 884 B7R1.4 CC1=CNN=C1C PI-41141 [0,0,0,0,1,0|3,0,0]=4 885 B7R1.4 CC1=CSC=C1C PI-35053 [0,0,0,0,1,0|2,0,0]=3 886 B7R1.4 CC1=NC=CN1C PI-31811 [0,0,0,0,1,0|3,0,0]=4 887 B7R1.4 CC1=NNC=C1Br PI-13601 [0,0,0,0,1,0|3,0,0]=4 888 B7R1.4 CC1=NNC=C1I PI-33035 [0,0,0,0,1,0|3,0,0]=4 889 B7R1.4 CN1C=CN=C1Cl PI-20160 [0,0,0,0,1,0|3,0,0]=4 890 B7R1.4 CN1C=CNC1=S PI-18739 [0,0,0,0,1,0|2,1,0]=4 891 B7R1.4 CN1C=NC=C1Cl PI-11701 [0,0,0,0,1,0|3,0,0]=4 892 B7R1.4 CN1C=NC=C1Cl PI-12996 [0,0,0,0,1,0|3,0,0]=4 893 B7R1.4 CN1C=NC=C1I PI-25811 [0,0,0,0,1,0|3,0,0]=4 894 B7R1.4 Cc1ccsc1Br PI-10990 [0,0,0,0,1,0|2,0,0]=3 895 B7R1.4 Clc1sccc1Cl PI-26200 [0,0,0,0,1,0|3,0,0]=4 896 B7R1.4 Cn1ccnc1Br PI-14474 [0,0,0,0,1,0|3,0,0]=4 897 B7R1.4 Cn1nccc1C PI-37575 [0,0,0,0,1,0|3,0,0]=4 898 B7R1.4 Cn1nccc1N PI-28081 [0,0,0,0,1,0|3,0,0]=4 899 B7R1.4 Cn1nccc1O PI-37212 [0,0,0,0,1,0|2,0,0]=3 900 B7R1.4 Cn1sccc1=O PI-11861 [0,0,0,0,1,0|2,0,1]=4 901 B7R1.4 Oc1cscc1O PI-33661 [0,0,0,0,1,0|2,0,0]=3 902 B7R1.4 SC1=C(C)OC=C1 PI-14227 [0,0,0,0,1,0|1,1,0]=3 903 B6R0.2 CC(=CC(=O)C)O PI-39500 [1,0,1,0,0,0|1,0,1]=4 904 B6R0.2 CC(=CC(=O)O)C PI-42632 [1,0,1,0,0,0|1,0,1]=4 905 B6R0.4 CC=CCC(=O)O PI-47130 [1,0,1,0,0,0|1,0,1]=4 906 B6R0.6 CC=CC=CCO PI-24146 [1,0,1,0,0,0|0,0,1]=3 907 B6R1.1 C1=CN=CC=N1 PI-14237 [2,0,0,0,0,0|2,0,0]=4 908 B6R1.1 c1[c-]cccc1 PI-15765 [2,0,0,0,0,0|0,0,1]=3 909 B6R1.1 c1[c-]cccc1 PI-24613 [2,0,0,0,0,0|0,0,1]=3 910 B6R1.1 c1cccn[c-]1 PI-24182 [2,0,0,0,0,0|1,0,1]=4 911 B6R1.1 c1cccnc1 PI-14207 [2,0,0,0,0,0|1,0,0]=3 912 B6R1.1 c1ccncn1 PI-11036 [2,0,0,0,0,0|2,0,0]=4 913 B8R0.28 CC(=C\C=C\C(=O)C)C PI-48754 [0,1,1,0,0,0|0,0,2]=4 914 B8R1.2 BrCC1=CC=CC=C1 PI-36476 [1,1,0,0,0,0|0,0,0]=2 915 B8R1.2 BrCC1=CN=CN=C1 PI-40551 [1,1,0,0,0,0|2,0,0]=4 916 B8R1.2 C#CC1=CC=CC=C1 PI-48958 [1,1,0,0,0,0|0,0,1]=3 917 B8R1.2 C#CC1=NC=CC=C1 PI-37137 [1,1,0,0,0,0|1,0,1]=4 918 B8R1.2 C1=C(C=NC=N1)CO PI-32945 [1,1,0,0,0,0|2,0,0]=4 919 B8R1.2 C1=C(N=CC=N1)CN PI-42651 [1,1,0,0,0,0|2,0,0]=4 920 B8R1.2 C1=CC(=CN=C1)CCl PI-16717 [1,1,0,0,0,0|1,0,0]=3 921 B8R1.2 C1=CC(=CN=C1)NN PI-39291 [1,1,0,0,0,0|2,0,0]=4 922 B8R1.2 C1=CC=NC(=C1)NN PI-46991 [1,1,0,0,0,0|2,0,0]=4 923 B8R1.2 C1=CC=NC(=C1)NN PI-50652 [1,1,0,0,0,0|2,0,0]=4 924 B8R1.2 C1=CN=C(N=C1)CO PI-35153 [1,1,0,0,0,0|2,0,0]=4 925 B8R1.2 C1=CN=CC=C1CCl PI-31734 [1,1,0,0,0,0|1,0,0]=3 926 B8R1.2 C1=CN=CC=C1CO PI-16744 [1,1,0,0,0,0|1,0,0]=3 927 B8R1.2 C1=CN=CN=C1CO PI-35498 [1,1,0,0,0,0|2,0,0]=4 928 B8R1.2 CCC1=CC=CC=N1 PI-49466 [1,1,0,0,0,0|1,0,0]=3 929 B8R1.2 CCC1=NC=CN=C1 PI-11040 [1,1,0,0,0,0|2,0,0]=4 930 B8R1.2 CC[N+]1=CC=CC=C1 PI-13342 [1,1,0,0,0,0|1,0,0]=3 931 B8R1.2 CC[N+]1=CC=CC=C1 PI-13347 [1,1,0,0,0,0|1,0,0]=3 932 B8R1.2 CNC1=CC=CC=N1 PI-11864 [1,1,0,0,0,0|1,0,0]=3 933 B8R1.2 CNC1=CC=NC=C1 PI-23603 [1,1,0,0,0,0|1,0,0]=3 934 B8R1.2 CNC1=CN=CC=C1 PI-11328 [1,1,0,0,0,0|1,0,0]=3 935 B8R1.2 COC1=CC=CC=N1 PI-33887 [1,1,0,0,0,0|1,0,0]=3 936 B8R1.2 COC1=CC=NC=C1 PI-10034 [1,1,0,0,0,0|1,0,0]=3 937 B8R1.2 COC1=CN=CC=C1 PI-33889 [1,1,0,0,0,0|1,0,0]=3 938 B8R1.2 COC1=NC=CN=C1 PI-11859 [1,1,0,0,0,0|2,0,0]=4 939 B8R1.2 CSC1=CC=CC=N1 PI-16757 [1,1,0,0,0,0|1,0,0]=3 940 B8R1.2 CSC1=NC=CN=C1 PI-11048 [1,1,0,0,0,0|2,0,0]=4 941 B8R1.2 ClCC1=CN=CC=N1 PI-39634 [1,1,0,0,0,0|2,0,0]=4 942 B8R1.2 ClCC1=NC=CC=C1 PI-11827 [1,1,0,0,0,0|1,0,0]=3 943 B8R1.2 ClCc1ccccn1 PI-16716 [1,1,0,0,0,0|1,0,0]=3 944 B8R1.2 ClCc1ncccn1 PI-35014 [1,1,0,0,0,0|2,0,0]=4 945 B8R1.2 ClCc1ncccn1 PI-40553 [1,1,0,0,0,0|2,0,0]=4 946 B8R1.2 NCC1=CC=CC=C1 PI-37209 [1,1,0,0,0,0|0,0,0]=2 947 B8R1.2 NCC1=CC=NC=C1 PI-41875 [1,1,0,0,0,0|1,0,0]=3 948 B8R1.2 NCc1ccccn1 PI-33905 [1,1,0,0,0,0|1,0,0]=3 949 B8R1.2 NCc1cccnc1 PI-15236 [1,1,0,0,0,0|1,0,0]=3 950 B8R1.2 NCc1ccncc1 PI-31790 [1,1,0,0,0,0|1,0,0]=3 951 B8R1.2 NCc1ncccn1 PI-34855 [1,1,0,0,0,0|2,0,0]=4 952 B8R1.2 NCc1ncccn1 PI-34856 [1,1,0,0,0,0|2,0,0]=4 953 B8R1.2 NNC1=CC=CC=C1 PI-41551 [1,1,0,0,0,0|1,0,0]=3 954 B8R1.2 O=Cc1ccccn1 PI-33895 [1,1,0,0,0,0|1,0,1]=4 955 B8R1.2 O=Cc1cccnc1 PI-33908 [1,1,0,0,0,0|1,0,1]=4 956 B8R1.2 O=Cc1ccncc1 PI-13140 [1,1,0,0,0,0|1,0,1]=4 957 B8R1.2 OCC1=CC=CN=C1 PI-11019 [1,1,0,0,0,0|1,0,0]=3 958 B8R1.2 OCC1=NC=CC=C1 PI-16261 [1,1,0,0,0,0|1,0,0]=3 959 B8R1.2 OCc1ccncc1 PI-16686 [1,1,0,0,0,0|1,0,0]=3 960 B8R1.2 ONc1ccccc1 PI-38448 [1,1,0,0,0,0|0,0,0]=2 961 B8R1.2 [C-]#CC1=CC=CC=C1 PI-48435 [1,1,0,0,0,0|0,0,1]=3 962 B8R1.3 Brc1ccc(C)cn1 PI-10149 [1,1,0,0,0,0|1,0,0]=3 963 B8R1.3 Brc1ccc(I)cc1 PI-21525 [1,1,0,0,0,0|1,0,0]=3 964 B8R1.3 Brc1ccc(cn1)F PI-23448 [1,1,0,0,0,0|2,0,0]=4 965 B8R1.3 Brc1ccc(cn1)N PI-31056 [1,1,0,0,0,0|2,0,0]=4 966 B8R1.3 C1=C(C=NC(=N1)Cl)O PI-40987 [1,1,0,0,0,0|2,0,0]=4 967 B8R1.3 C1=C(I)C=CC(=N1)Br PI-38918 [1,1,0,0,0,0|2,0,0]=4 968 B8R1.3 C1=CC(=CC=C1Cl)Br PI-48678 [1,1,0,0,0,0|1,0,0]=3 969 B8R1.3 C1=CC(=CC=C1Cl)I PI-20137 [1,1,0,0,0,0|1,0,0]=3 970 B8R1.3 C1=CC(=CC=C1F)S PI-17595 [1,1,0,0,0,0|0,1,0]=3 971 B8R1.3 C1=CC(=CC=C1F)[S-] PI-28110 [1,1,0,0,0,0|0,1,0]=3 972 B8R1.3 C1=CC(=CC=C1N)S PI-14246 [1,1,0,0,0,0|0,1,0]=3 973 B8R1.3 C1=CC(=CC=C1S)Br PI-21352 [1,1,0,0,0,0|0,1,0]=3 974 B8R1.3 C1=CC(=NC=C1Br)F PI-23450 [1,1,0,0,0,0|2,0,0]=4 975 B8R1.3 C1=CC(=NC=C1Br)I PI-22827 [1,1,0,0,0,0|2,0,0]=4 976 B8R1.3 C1=CC(=NC=C1Cl)Br PI-10389 [1,1,0,0,0,0|2,0,0]=4 977 B8R1.3 C1=CC(=NC=C1Cl)F PI-16762 [1,1,0,0,0,0|2,0,0]=4 978 B8R1.3 C1=CC(=NC=C1Cl)I PI-34652 [1,1,0,0,0,0|2,0,0]=4 979 B8R1.3 C1=CC(=NC=C1F)Cl PI-10085 [1,1,0,0,0,0|2,0,0]=4 980 B8R1.3 C1=CC(=NC=C1F)N PI-23434 [1,1,0,0,0,0|2,0,0]=4 981 B8R1.3 C1=CC(=NC=C1I)Cl PI-20140 [1,1,0,0,0,0|2,0,0]=4 982 B8R1.3 C1=CC(=NC=C1I)F PI-16769 [1,1,0,0,0,0|2,0,0]=4 983 B8R1.3 C1=CC(=NC=C1N)N PI-33879 [1,1,0,0,0,0|2,0,0]=4 984 B8R1.3 C1=CC(=NC=C1O)Cl PI-10086 [1,1,0,0,0,0|1,0,0]=3 985 B8R1.3 C1=CC(=NC=C1O)I PI-34186 [1,1,0,0,0,0|1,0,0]=3 986 B8R1.3 C1=CC(=NC=C1O)N PI-34189 [1,1,0,0,0,0|1,0,0]=3 987 B8R1.3 CC1=CN=C(C=C1)F PI-34372 [1,1,0,0,0,0|1,0,0]=3 988 B8R1.3 CC1=CN=C(C=N1)C PI-29099 [1,1,0,0,0,0|2,0,0]=4 989 B8R1.3 CC1=CN=C(C=N1)N PI-48187 [1,1,0,0,0,0|2,0,0]=4 990 B8R1.3 CC1=CNC(=O)C=C1 PI-15774 [1,1,0,0,0,0|1,0,0]=3 991 B8R1.3 CC1=NC=C(C=C1)F PI-16773 [1,1,0,0,0,0|1,0,0]=3 992 B8R1.3 CC1=NC=C(C=C1)O PI-11928 [1,1,0,0,0,0|1,0,0]=3 993 B8R1.3 CC1=NC=C(C=N1)Br PI-35175 [1,1,0,0,0,0|2,0,0]=4 994 B8R1.3 CC1=NC=C(C=N1)F PI-45025 [1,1,0,0,0,0|2,0,0]=4 995 B8R1.3 CC1=NC=C(C=N1)N PI-32948 [1,1,0,0,0,0|2,0,0]=4 996 B8R1.3 CC1=NC=C(C=N1)O PI-42081 [1,1,0,0,0,0|2,0,0]=4 997 B8R1.3 CC1=NN=C(C=C1)N PI-44739 [1,1,0,0,0,0|2,0,0]=4 998 B8R1.3 CC1=NNC(=O)C=C1 PI-44765 [1,1,0,0,0,0|2,0,0]=4 999 B8R1.3 Cc1ccc(Cl)cn1 PI-36942 [1,1,0,0,0,0|1,0,0]=3 1000 B8R1.3 Cc1ccc(Cl)nn1 PI-30064 [1,1,0,0,0,0|2,0,0]=4 1001 B8R1.3 Cc1ccc(F)cc1 PI-34120 [1,1,0,0,0,0|0,0,0]=2 1002 B8R1.3 Cc1ccc(I)cc1 PI-13709 [1,1,0,0,0,0|0,0,0]=2 1003 B8R1.3 Cc1ccc(cn1)Br PI-23479 [1,1,0,0,0,0|1,0,0]=3 1004 B8R1.3 Cc1ccc(cn1)N PI-13104 [1,1,0,0,0,0|1,0,0]=3 1005 B8R1.3 Cc1ncc(nc1)Br PI-36981 [1,1,0,0,0,0|2,0,0]=4 1006 B8R1.3 Clc1ccc(Br)cn1 PI-31223 [1,1,0,0,0,0|2,0,0]=4 1007 B8R1.3 Clc1ccc(Cl)nc1 PI-10179 [1,1,0,0,0,0|2,0,0]=4 1008 B8R1.3 Clc1ccc(cn1)C PI-16696 [1,1,0,0,0,0|1,0,0]=3 1009 B8R1.3 Clc1ccc(cn1)N PI-10026 [1,1,0,0,0,0|2,0,0]=4 1010 B8R1.3 Clc1cnc(O)nc1 PI-21321 [1,1,0,0,0,0|2,0,0]=4 1011 B8R1.3 FC1=CC=C(Br)C=C1 PI-33066 [1,1,0,0,0,0|1,0,0]=3 1012 B8R1.3 FC1=NC=C(C=C1)O PI-40204 [1,1,0,0,0,0|1,0,0]=3 1013 B8R1.3 Fc1ccc(I)cc1 PI-15769 [1,1,0,0,0,0|1,0,0]=3 1014 B8R1.3 Fc1ccc(N)cn1 PI-10292 [1,1,0,0,0,0|2,0,0]=4 1015 B8R1.3 Fc1ccc(cc1)F PI-11683 [1,1,0,0,0,0|1,0,0]=3 1016 B8R1.3 Fc1ccc(cn1)F PI-35922 [1,1,0,0,0,0|2,0,0]=4 1017 B8R1.3 Ic1ccc(cc1)I PI-10976 [1,1,0,0,0,0|1,0,0]=3 1018 B8R1.3 Ic1ccc(cn1)I PI-32190 [1,1,0,0,0,0|2,0,0]=4 1019 B8R1.3 NC1=CN=C(N)C=C1 PI-16689 [1,1,0,0,0,0|2,0,0]=4 1020 B8R1.3 Nc1ccc(O)cc1 PI-34110 [1,1,0,0,0,0|0,0,0]=2 1021 B8R1.3 Nc1ccc(cc1)F PI-33065 [1,1,0,0,0,0|1,0,0]=3 1022 B8R1.3 Nc1ccc(cc1)I PI-25653 [1,1,0,0,0,0|1,0,0]=3 1023 B8R1.3 Nc1ccc(cn1)Br PI-22846 [1,1,0,0,0,0|2,0,0]=4 1024 B8R1.3 Nc1ccc(cn1)C PI-25208 [1,1,0,0,0,0|1,0,0]=3 1025 B8R1.3 Nc1ccc(cn1)Cl PI-31015 [1,1,0,0,0,0|2,0,0]=4 1026 B8R1.3 Nc1ccc(cn1)I PI-10252 [1,1,0,0,0,0|2,0,0]=4 1027 B8R1.3 OC1=CN=C(Br)C=C1 PI-40203 [1,1,0,0,0,0|1,0,0]=3 1028 B8R1.3 OC1=NC=C(N)C=C1 PI-37317 [1,1,0,0,0,0|1,0,0]=3 1029 B8R1.3 Oc1ccc(Br)cc1 PI-22230 [1,1,0,0,0,0|0,0,0]=2 1030 B8R1.3 Oc1ccc(I)cc1 PI-10956 [1,1,0,0,0,0|0,0,0]=2 1031 B8R1.3 Oc1ccc(cc1)F PI-27532 [1,1,0,0,0,0|0,0,0]=2 1032 B8R1.3 Oc1ccc(cc1)S PI-21361 [1,1,0,0,0,0|0,0,0]=2 1033 B8R1.3 Oc1ccc(cn1)Br PI-16568 [1,1,0,0,0,0|1,0,0]=3 1034 B8R1.3 Oc1ccc(cn1)C PI-37410 [1,1,0,0,0,0|1,0,0]=3 1035 B8R1.3 Oc1ccc(cn1)Cl PI-15823 [1,1,0,0,0,0|1,0,0]=3 1036 B8R1.3 Oc1ccc(cn1)F PI-34437 [1,1,0,0,0,0|1,0,0]=3 1037 B8R1.3 Oc1ccc(cn1)N PI-28402 [1,1,0,0,0,0|1,0,0]=3 1038 B8R1.3 Oc1cnc(N)nc1 PI-36493 [1,1,0,0,0,0|2,0,0]=4 1039 B8R1.3 [O-][n+]1ccc(cc1)C PI-33172 [1,1,0,0,0,0|1,0,0]=3 1040 B8R1.5 BrC1=NC=CC=C1N PI-28492 [1,1,0,0,0,0|2,0,0]=4 1041 B8R1.5 Brc1ccccc1Br PI-38145 [1,1,0,0,0,0|1,0,0]=3 1042 B8R1.5 Brc1cccnc1Cl PI-28602 [1,1,0,0,0,0|2,0,0]=4 1043 B8R1.5 Brc1cccnc1N PI-30126 [1,1,0,0,0,0|2,0,0]=4 1044 B8R1.5 C1=CC(=C(N=C1)Br)Br PI-28122 [1,1,0,0,0,0|2,0,0]=4 1045 B8R1.5 C1=CC(=C(N=C1)Br)Cl PI-27992 [1,1,0,0,0,0|2,0,0]=4 1046 B8R1.5 C1=CC(=C(N=C1)Br)F PI-34450 [1,1,0,0,0,0|2,0,0]=4 1047 B8R1.5 C1=CC(=C(N=C1)Cl)Cl PI-10112 [1,1,0,0,0,0|2,0,0]=4 1048 B8R1.5 C1=CC(=C(N=C1)Cl)F PI-16375 [1,1,0,0,0,0|2,0,0]=4 1049 B8R1.5 C1=CC(=C(N=C1)Cl)I PI-11389 [1,1,0,0,0,0|2,0,0]=4 1050 B8R1.5 C1=CC(=C(N=C1)Cl)O PI-16697 [1,1,0,0,0,0|1,0,0]=3 1051 B8R1.5 C1=CC(=C(N=C1)F)I PI-16040 [1,1,0,0,0,0|2,0,0]=4 1052 B8R1.5 C1=CC(=C(N=C1)F)N PI-16374 [1,1,0,0,0,0|2,0,0]=4 1053 B8R1.5 C1=CC(=C(N=C1)F)O PI-40205 [1,1,0,0,0,0|1,0,0]=3 1054 B8R1.5 C1=CC(=C(N=C1)N)Cl PI-31793 [1,1,0,0,0,0|2,0,0]=4 1055 B8R1.5 C1=CC(=O)N(C=C1)O PI-43160 [1,1,0,0,0,0|1,0,0]=3 1056 B8R1.5 C1=CC(=S)N(C=C1)O PI-13313 [1,1,0,0,0,0|1,0,0]=3 1057 B8R1.5 C1=CC(=S)N(C=C1)O PI-15830 [1,1,0,0,0,0|1,0,0]=3 1058 B8R1.5 C1=CC=C(C(=C1)Cl)Br PI-41004 [1,1,0,0,0,0|1,0,0]=3 1059 B8R1.5 C1=CC=C(C(=C1)Cl)Cl PI-21004 [1,1,0,0,0,0|1,0,0]=3 1060 B8R1.5 C1=CC=C(C(=C1)F)I PI-23606 [1,1,0,0,0,0|1,0,0]=3 1061 B8R1.5 C1=CC=C(C(=C1)F)S PI-16911 [1,1,0,0,0,0|0,1,0]=3 1062 B8R1.5 C1=CC=C(C(=C1)N)I PI-10964 [1,1,0,0,0,0|1,0,0]=3 1063 B8R1.5 C1=CC=C(C(=C1)N)N PI-17100 [1,1,0,0,0,0|1,0,0]=3 1064 B8R1.5 C1=CC=C(C(=C1)O)F PI-11848 [1,1,0,0,0,0|0,0,0]=2 1065 B8R1.5 C1=CC=[N+](C(=C1)Br)[O-] PI-10991 [1,1,0,0,0,0|1,0,1]=4 1066 B8R1.5 C1=CC=[N+](C(=C1)Br)[O-] PI-31783 [1,1,0,0,0,0|1,0,1]=4 1067 B8R1.5 C1=CC=[N+](C(=C1)Cl)[O-] PI-11832 [1,1,0,0,0,0|1,0,1]=4 1068 B8R1.5 C1=CC=[N+](C(=C1)Cl)[O-] PI-42568 [1,1,0,0,0,0|1,0,1]=4 1069 B8R1.5 C1=CN=C(C(=N1)C)N PI-40999 [1,1,0,0,0,0|2,0,0]=4 1070 B8R1.5 C1=CN=CC(=C1Cl)Br PI-28453 [1,1,0,0,0,0|2,0,0]=4 1071 B8R1.5 C1=CN=CC(=C1Cl)Cl PI-28640 [1,1,0,0,0,0|2,0,0]=4 1072 B8R1.5 C1=CN=CC(=C1Cl)F PI-10413 [1,1,0,0,0,0|2,0,0]=4 1073 B8R1.5 C1=CN=CC(=C1Cl)N PI-28262 [1,1,0,0,0,0|2,0,0]=4 1074 B8R1.5 C1=CN=CC(=C1I)F PI-34425 [1,1,0,0,0,0|2,0,0]=4 1075 B8R1.5 C1=CNC(=O)C(=C1)Cl PI-35282 [1,1,0,0,0,0|1,0,1]=4 1076 B8R1.5 C1=CNC(=O)C(=C1)F PI-34509 [1,1,0,0,0,0|1,0,1]=4 1077 B8R1.5 C1=CNC(=O)C(=C1)N PI-10375 [1,1,0,0,0,0|1,0,1]=4 1078 B8R1.5 C1=CNC(=S)C(=C1)N PI-36113 [1,1,0,0,0,0|1,1,0]=4 1079 B8R1.5 C1=CNC=C(C1=O)N PI-28705 [1,1,0,0,0,0|1,0,1]=4 1080 B8R1.5 CC1=C(Br)C=CN=C1 PI-40508 [1,1,0,0,0,0|1,0,0]=3 1081 B8R1.5 CC1=C(C=CC=N1)Br PI-23460 [1,1,0,0,0,0|1,0,0]=3 1082 B8R1.5 CC1=C(C=CN=C1)Cl PI-40252 [1,1,0,0,0,0|1,0,0]=3 1083 B8R1.5 CC1=C(C=CN=C1)N PI-14242 [1,1,0,0,0,0|1,0,0]=3 1084 B8R1.5 CC1=C(C=NC=C1)F PI-16771 [1,1,0,0,0,0|1,0,0]=3 1085 B8R1.5 CC1=C(C=NC=C1)O PI-34258 [1,1,0,0,0,0|1,0,0]=3 1086 B8R1.5 CC1=C(N=CC=C1)F PI-16763 [1,1,0,0,0,0|1,0,0]=3 1087 B8R1.5 CC1=C(N=CC=C1)N PI-33812 [1,1,0,0,0,0|1,0,0]=3 1088 B8R1.5 CC1=CC=CC=C1I PI-10980 [1,1,0,0,0,0|0,0,0]=2 1089 B8R1.5 CC1=CC=CC=[N+]1N PI-45950 [1,1,0,0,0,0|1,0,0]=3 1090 B8R1.5 CC1=NC=CN=C1C PI-11734 [1,1,0,0,0,0|2,0,0]=4 1091 B8R1.5 CC1=NC=CN=C1Cl PI-11816 [1,1,0,0,0,0|2,0,0]=4 1092 B8R1.5 CC1=NC=CNC1=O PI-40998 [1,1,0,0,0,0|2,0,0]=4 1093 B8R1.5 Cc1ccccc1F PI-34118 [1,1,0,0,0,0|0,0,0]=2 1094 B8R1.5 Cc1cccnc1Br PI-28405 [1,1,0,0,0,0|1,0,0]=3 1095 B8R1.5 Cc1cccnc1Cl PI-33878 [1,1,0,0,0,0|1,0,0]=3 1096 B8R1.5 Cc1ccncc1Br PI-23509 [1,1,0,0,0,0|1,0,0]=3 1097 B8R1.5 Cc1ccncc1N PI-24336 [1,1,0,0,0,0|1,0,0]=3 1098 B8R1.5 Cc1ccnnc1Cl PI-34083 [1,1,0,0,0,0|2,0,0]=4 1099 B8R1.5 Cc1cnccc1Br PI-33360 [1,1,0,0,0,0|1,0,0]=3 1100 B8R1.5 Cc1cnccc1O PI-38275 [1,1,0,0,0,0|1,0,0]=3 1101 B8R1.5 Clc1cccc[n+]1C PI-17309 [1,1,0,0,0,0|1,0,0]=3 1102 B8R1.5 FC1=NC=CC=C1Br PI-34449 [1,1,0,0,0,0|2,0,0]=4 1103 B8R1.5 Fc1ccccc1Br PI-33063 [1,1,0,0,0,0|1,0,0]=3 1104 B8R1.5 Fc1ccccc1F PI-11671 [1,1,0,0,0,0|1,0,0]=3 1105 B8R1.5 Fc1cnccc1Br PI-10110 [1,1,0,0,0,0|2,0,0]=4 1106 B8R1.5 Fc1ncccc1F PI-16764 [1,1,0,0,0,0|2,0,0]=4 1107 B8R1.5 IC1=CC=CC=C1Br PI-21523 [1,1,0,0,0,0|1,0,0]=3 1108 B8R1.5 IC1=CC=CC=C1I PI-21274 [1,1,0,0,0,0|1,0,0]=3 1109 B8R1.5 Ic1cccnc1N PI-36512 [1,1,0,0,0,0|2,0,0]=4 1110 B8R1.5 NC1=C(C=NC=C1)F PI-40470 [1,1,0,0,0,0|2,0,0]=4 1111 B8R1.5 Nc1cccnc1C PI-13066 [1,1,0,0,0,0|1,0,0]=3 1112 B8R1.5 Nc1cccnc1Cl PI-24529 [1,1,0,0,0,0|2,0,0]=4 1113 B8R1.5 Nc1cccnc1N PI-10159 [1,1,0,0,0,0|2,0,0]=4 1114 B8R1.5 Nc1ccncc1Br PI-16045 [1,1,0,0,0,0|2,0,0]=4 1115 B8R1.5 Nc1cnccc1I PI-36511 [1,1,0,0,0,0|2,0,0]=4 1116 B8R1.5 Nc1cnccc1N PI-16569 [1,1,0,0,0,0|2,0,0]=4 1117 B8R1.5 O=c1[nH]cccc1C PI-16687 [1,1,0,0,0,0|1,0,0]=3 1118 B8R1.5 O=c1ccccn1C PI-10985 [1,1,0,0,0,0|1,0,0]=3 1119 B8R1.5 OC1=C(I)C=CC=C1 PI-10953 [1,1,0,0,0,0|0,0,0]=2 1120 B8R1.5 OC1=NC=CC=C1Br PI-37057 [1,1,0,0,0,0|1,0,0]=3 1121 B8R1.5 Oc1ccccc1Br PI-10952 [1,1,0,0,0,0|0,0,0]=2 1122 B8R1.5 Oc1ccccc1O PI-31351 [1,1,0,0,0,0|0,0,0]=2 1123 B8R1.5 Oc1ccccc1S PI-20878 [1,1,0,0,0,0|0,0,0]=2 1124 B8R1.5 Oc1cccnc1Br PI-16727 [1,1,0,0,0,0|1,0,0]=3 1125 B8R1.5 Oc1cccnc1C PI-13315 [1,1,0,0,0,0|1,0,0]=3 1126 B8R1.5 Oc1cccnc1N PI-16260 [1,1,0,0,0,0|1,0,0]=3 1127 B8R1.5 Oc1ccncc1Br PI-38971 [1,1,0,0,0,0|1,0,0]=3 1128 B8R1.5 Oc1ncccc1O PI-11386 [1,1,0,0,0,0|1,0,0]=3 1129 B8R1.5 [S-]c1cccc[n+]1[O-] PI-15322 [1,1,0,0,0,0|1,0,1]=4 1130 B8R1.5 [S-]c1cccc[n+]1[O-] PI-15323 [1,1,0,0,0,0|1,0,1]=4 1131 B8R1.1 C1=C(SC(=C1)Br)CO PI-45451 [0,1,0,0,1,0|2,0,0]=4 1132 B8R1.1 C1=C(SC(=C1)Cl)CCl PI-27377 [0,1,0,0,1,0|2,0,0]=4 1133 B8R1.1 C1=C(SC(=C1)Cl)CO PI-45044 [0,1,0,0,1,0|2,0,0]=4 1134 B8R1.1 CC1=CC=C(O1)C=O PI-44598 [0,1,0,0,1,0|1,0,1]=4 1135 B8R1.1 CC1=CC=C(O1)CN PI-43985 [0,1,0,0,1,0|2,0,0]=4 1136 B8R1.1 CC1=CSC(=C1)C=O PI-29744 [0,1,0,0,1,0|1,0,1]=4 1137 B8R1.1 Cc1cc(no1)CO PI-20812 [0,1,0,0,1,0|2,0,0]=4 1138 B8R1.1 Cc1ccc(C=O)s1 PI-10821 [0,1,0,0,1,0|1,0,1]=4 1139 B8R1.18 CC1=C(SC(=C1)Cl)Cl PI-14314 [0,1,0,0,1,0|2,0,0]=4 1140 B8R1.18 CC1=CC(=C(O1)C)S PI-48469 [0,1,0,0,1,0|1,1,0]=4 1141 B8R1.18 CC1=CC(=C(S1)C)C PI-29262 [0,1,0,0,1,0|2,0,0]=4 1142 B8R1.11 C1=CSC(=C1CCl)Cl PI-35066 [0,1,0,0,1,0|2,0,0]=4 1143 B8R1.11 C1=CSC(=C1CN)Br PI-14463 [0,1,0,0,1,0|2,0,0]=4 1144 B8R1.11 CC1=C(C=CO1)SC PI-14230 [0,1,0,0,1,0|1,1,0]=4 1145 B8R1.11 CC1=C(CO)NC=N1 PI-11991 [0,1,0,0,1,0|2,0,0]=4 1146 B8R1.11 CC1=C(N=CN1)CO PI-32341 [0,1,0,0,1,0|2,0,0]=4 1147 B8R1.11 CC1=C(SC=C1)C#N PI-30712 [0,1,0,0,1,0|2,0,0]=4 1148 B8R1.11 CC1=C(SC=C1)C=O PI-10802 [0,1,0,0,1,0|1,0,1]=4 1149 B8R1.11 CCC1=CC=CN1N PI-40301 [0,1,0,0,1,0|2,0,0]=4 1150 B8R1.11 CN1C=CC=C1C=O PI-33707 [0,1,0,0,1,0|1,0,1]=4 1151 B8R1.11 CN1C=CN=C1CO PI-33166 [0,1,0,0,1,0|2,0,0]=4 1152 B8R1.11 COC1=C(SC=C1)Br PI-39262 [0,1,0,0,1,0|2,0,0]=4 1153 B8R1.11 N#Cc1cccn1C PI-34307 [0,1,0,0,1,0|2,0,0]=4 1154 B10R1.2 C1=CC(=C(C(=C1)Br)O)C=O PI-27283 [0,2,0,0,0,0|1,0,1]=4 1155 B10R1.2 C1=CC(=C(C(=C1)Cl)Cl)C#N PI-13129 [0,2,0,0,0,0|1,0,1]=4 1156 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C#N PI-10522 [0,2,0,0,0,0|1,0,1]=4 1157 B10R1.2 C1=CC(=C(C(=C1)Cl)F)CBr PI-28865 [0,2,0,0,0,0|1,0,0]=3 1158 B10R1.2 C1=CC(=C(C(=C1)Cl)F)NN PI-10632 [0,2,0,0,0,0|2,0,0]=4 1159 B10R1.2 C1=CC(=C(C(=C1)Cl)N)C#N PI-11515 [0,2,0,0,0,0|1,0,1]=4 1160 B10R1.2 C1=CC(=C(C(=C1)F)Br)C#N PI-10685 [0,2,0,0,0,0|1,0,1]=4 1161 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C#N PI-10693 [0,2,0,0,0,0|1,0,1]=4 1162 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C=O PI-28939 [0,2,0,0,0,0|1,0,1]=4 1163 B10R1.2 C1=CC(=C(C(=C1)F)F)C#N PI-28273 [0,2,0,0,0,0|1,0,1]=4 1164 B10R1.2 C1=CC(=C(C(=C1)F)F)C=O PI-28322 [0,2,0,0,0,0|1,0,1]=4 1165 B10R1.2 C1=CC(=C(C(=C1)F)F)CBr PI-28061 [0,2,0,0,0,0|1,0,0]=3 1166 B10R1.2 C1=CC(=C(C(=C1)F)F)CN PI-21148 [0,2,0,0,0,0|1,0,0]=3 1167 B10R1.2 C1=CC(=C(C(=C1)F)F)CO PI-21147 [0,2,0,0,0,0|1,0,0]=3 1168 B10R1.2 C1=CC(=C(C(=C1)F)N)C#N PI-10681 [0,2,0,0,0,0|1,0,1]=4 1169 B10R1.2 C1=CC(=C(C(=C1)F)O)C=O PI-18520 [0,2,0,0,0,0|1,0,1]=4 1170 B10R1.2 CC1=C(C(=CC=C1)C#N)C PI-21940 [0,2,0,0,0,0|1,0,0]=3 1171 B10R1.2 CC1=C(C(=CC=C1)C#N)F PI-10707 [0,2,0,0,0,0|1,0,0]=3 1172 B10R1.2 CC1=C(C(=CC=C1)C=O)C PI-10267 [0,2,0,0,0,0|0,0,1]=3 1173 B10R1.2 CC1=C(C(=CC=C1)CBr)C PI-19918 [0,2,0,0,0,0|1,0,0]=3 1174 B10R1.2 CC1=C(C(=CC=C1)CBr)F PI-23752 [0,2,0,0,0,0|1,0,0]=3 1175 B10R1.2 CC1=C(C(=CC=C1)NN)C PI-29705 [0,2,0,0,0,0|1,0,0]=3 1176 B10R1.2 CC1=C(C(=CC=C1)OC)C PI-33340 [0,2,0,0,0,0|0,0,0]=2 1177 B10R1.2 CC1=C(C=CC=C1Cl)OC PI-19448 [0,2,0,0,0,0|1,0,0]=3 1178 B10R1.2 CC1=C(C=CC=C1F)C=O PI-28157 [0,2,0,0,0,0|1,0,1]=4 1179 B10R1.2 CC1=C(C=CC=C1N)CO PI-44883 [0,2,0,0,0,0|1,0,0]=3 1180 B10R1.2 CC1=C(C=CC=C1N)CO PI-44908 [0,2,0,0,0,0|1,0,0]=3 1181 B10R1.2 CC1=C(C=CC=C1OC)N PI-19271 [0,2,0,0,0,0|1,0,0]=3 1182 B10R1.2 CCC1=CC=CC(=C1N)C PI-34080 [0,2,0,0,0,0|1,0,0]=3 1183 B10R1.2 COC1=C(C(=CC=C1)F)Br PI-34352 [0,2,0,0,0,0|1,0,0]=3 1184 B10R1.2 COC1=C(C(=CC=C1)F)F PI-28119 [0,2,0,0,0,0|1,0,0]=3 1185 B10R1.2 COC1=CC=CC(=C1Cl)N PI-34739 [0,2,0,0,0,0|1,0,0]=3 1186 B10R1.2 COc1cccc(O)c1Br PI-34766 [0,2,0,0,0,0|0,0,0]=2 1187 B10R1.2 COc1cccc(c1N)O PI-38206 [0,2,0,0,0,0|0,0,0]=2 1188 B10R1.2 COc1cccc(c1O)O PI-19986 [0,2,0,0,0,0|0,0,0]=2 1189 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 PI-39859 [0,2,0,0,0,0|1,0,0]=3 1190 B10R1.2 FC1=C(Cl)C(CBr)=CC=C1 PI-39696 [0,2,0,0,0,0|1,0,0]=3 1191 B10R1.2 N#Cc1cccc(Br)c1F PI-21438 [0,2,0,0,0,0|1,0,1]=4 1192 B10R1.2 N#Cc1cccc(c1C)F PI-28230 [0,2,0,0,0,0|1,0,1]=4 1193 B10R1.2 N#Cc1cccc(c1I)F PI-10699 [0,2,0,0,0,0|1,0,1]=4 1194 B10R1.2 N#Cc1cccc(c1N)Br PI-38203 [0,2,0,0,0,0|1,0,1]=4 1195 B10R1.2 N#Cc1cccc(c1O)O PI-31955 [0,2,0,0,0,0|0,0,1]=3 1196 B10R1.2 NCC1=CC=CC(F)=C1Br PI-46659 [0,2,0,0,0,0|1,0,0]=3 1197 B10R1.2 NCc1cccc(Cl)c1F PI-20073 [0,2,0,0,0,0|1,0,0]=3 1198 B10R1.2 NNC1=CC=CC(Cl)=C1Cl PI-21067 [0,2,0,0,0,0|2,0,0]=4 1199 B10R1.2 O=CC1=CC=CC(F)=C1Br PI-28928 [0,2,0,0,0,0|1,0,1]=4 1200 B10R1.2 O=CC1=CC=CC(F)=C1I PI-28940 [0,2,0,0,0,0|1,0,1]=4 1201 B10R1.2 O=Cc1cccc(Br)c1F PI-36808 [0,2,0,0,0,0|1,0,1]=4 1202 B10R1.2 O=Cc1cccc(C)c1F PI-28944 [0,2,0,0,0,0|0,0,1]=3 1203 B10R1.2 O=Cc1cccc(C)c1O PI-27937 [0,2,0,0,0,0|0,0,1]=3 1204 B10R1.2 O=Cc1cccc(Cl)c1Cl PI-12552 [0,2,0,0,0,0|1,0,1]=4 1205 B10R1.2 O=Cc1cccc(Cl)c1O PI-26254 [0,2,0,0,0,0|1,0,1]=4 1206 B10R1.2 O=Cc1cccc(O)c1O PI-21380 [0,2,0,0,0,0|0,0,1]=3 1207 B10R1.2 O=Cc1cccc(c1F)Cl PI-28866 [0,2,0,0,0,0|1,0,1]=4 1208 B10R1.8 BrCC1=CC(Br)=CC(Br)=C1 PI-30725 [0,2,0,0,0,0|1,0,0]=3 1209 B10R1.8 C1=C(C=C(C=C1Br)Br)CO PI-30149 [0,2,0,0,0,0|1,0,0]=3 1210 B10R1.8 C1=C(C=C(C=C1Br)I)C=O PI-26241 [0,2,0,0,0,0|1,0,1]=4 1211 B10R1.8 C1=C(C=C(C=C1Cl)Br)C#N PI-35892 [0,2,0,0,0,0|1,0,1]=4 1212 B10R1.8 C1=C(C=C(C=C1Cl)Cl)C=O PI-11890 [0,2,0,0,0,0|1,0,1]=4 1213 B10R1.8 C1=C(C=C(C=C1Cl)Cl)CN PI-21013 [0,2,0,0,0,0|1,0,0]=3 1214 B10R1.8 C1=C(C=C(C=C1Cl)Cl)CO PI-30760 [0,2,0,0,0,0|1,0,0]=3 1215 B10R1.8 C1=C(C=C(C=C1Cl)Cl)NN PI-21068 [0,2,0,0,0,0|2,0,0]=4 1216 B10R1.8 C1=C(C=C(C=C1F)Br)C=O PI-28238 [0,2,0,0,0,0|1,0,1]=4 1217 B10R1.8 C1=C(C=C(C=C1F)Cl)C=O PI-27970 [0,2,0,0,0,0|1,0,1]=4 1218 B10R1.8 C1=C(C=C(C=C1F)F)CBr PI-16885 [0,2,0,0,0,0|1,0,0]=3 1219 B10R1.8 C1=C(C=C(C=C1F)F)CN PI-33740 [0,2,0,0,0,0|1,0,0]=3 1220 B10R1.8 C1=C(C=C(C=C1F)F)NN PI-10425 [0,2,0,0,0,0|2,0,0]=4 1221 B10R1.8 C1=C(C=C(C=C1F)F)NN PI-50548 [0,2,0,0,0,0|2,0,0]=4 1222 B10R1.8 CC1=CC(=CC(=C1)Br)OC PI-19403 [0,2,0,0,0,0|0,0,0]=2 1223 B10R1.8 CC1=CC(=CC(=C1)C#N)C PI-23424 [0,2,0,0,0,0|1,0,0]=3 1224 B10R1.8 CC1=CC(=CC(=C1)CBr)C PI-24287 [0,2,0,0,0,0|1,0,0]=3 1225 B10R1.8 CC1=CC(=CC(=C1)CN)C PI-21942 [0,2,0,0,0,0|1,0,0]=3 1226 B10R1.8 CC1=CC(=CC(=C1)F)C#N PI-10708 [0,2,0,0,0,0|1,0,0]=3 1227 B10R1.8 CC1=CC(=CC(=C1)NN)C PI-21975 [0,2,0,0,0,0|1,0,0]=3 1228 B10R1.8 CC1=CC(=CC(=O)O1)OC PI-48746 [0,2,0,0,0,0|1,0,0]=3 1229 B10R1.8 CC1=CC(=NC(=N1)N)OC PI-30926 [0,2,0,0,0,0|2,0,0]=4 1230 B10R1.8 CC1=CC(CCl)=CC(Cl)=N1 PI-41850 [0,2,0,0,0,0|2,0,0]=4 1231 B10R1.8 CC1=NC(OC)=CC(Cl)=N1 PI-46743 [0,2,0,0,0,0|2,0,0]=4 1232 B10R1.8 CNC1=CC(=NC(=C1)Cl)Cl PI-47310 [0,2,0,0,0,0|2,0,0]=4 1233 B10R1.8 COC1=CC(=CC(=C1)Br)Br PI-19875 [0,2,0,0,0,0|1,0,0]=3 1234 B10R1.8 COC1=CC(=CC(=C1)Cl)F PI-20056 [0,2,0,0,0,0|1,0,0]=3 1235 B10R1.8 COC1=CC(Cl)=CC(Br)=C1 PI-41830 [0,2,0,0,0,0|1,0,0]=3 1236 B10R1.8 COc1cc(C)cc(c1)C PI-34203 [0,2,0,0,0,0|0,0,0]=2 1237 B10R1.8 COc1cc(C)nc(Cl)n1 PI-36372 [0,2,0,0,0,0|2,0,0]=4 1238 B10R1.8 COc1cc(F)cc(F)c1 PI-31329 [0,2,0,0,0,0|1,0,0]=3 1239 B10R1.8 COc1cc(F)cc(c1)Br PI-10475 [0,2,0,0,0,0|1,0,0]=3 1240 B10R1.8 COc1cc(O)cc(c1)O PI-17720 [0,2,0,0,0,0|0,0,0]=2 1241 B10R1.8 CSC1=CC(=CC(=C1)Cl)Cl PI-11896 [0,2,0,0,0,0|1,0,0]=3 1242 B10R1.8 CSc1nc(O)cc(n1)O PI-11954 [0,2,0,0,0,0|2,0,0]=4 1243 B10R1.8 ClCc1cc(F)cc(c1)F PI-21151 [0,2,0,0,0,0|1,0,0]=3 1244 B10R1.8 IC1=CC(C=O)=CC(I)=C1 PI-26205 [0,2,0,0,0,0|1,0,1]=4 1245 B10R1.8 N#CC1=CC(Cl)=CC(Cl)=C1 PI-11892 [0,2,0,0,0,0|1,0,1]=4 1246 B10R1.8 N#Cc1cc(Br)cc(c1)Br PI-36979 [0,2,0,0,0,0|1,0,1]=4 1247 B10R1.8 N#Cc1cc(F)cc(c1)Br PI-16500 [0,2,0,0,0,0|1,0,1]=4 1248 B10R1.8 N#Cc1cc(F)cc(c1)F PI-31253 [0,2,0,0,0,0|1,0,1]=4 1249 B10R1.8 N#Cc1cc(N)cc(c1)F PI-15920 [0,2,0,0,0,0|1,0,1]=4 1250 B10R1.8 N#Cc1cc(O)cc(c1)Cl PI-39164 [0,2,0,0,0,0|0,0,1]=3 1251 B10R1.8 NC1=CC(C)=CC(OC)=C1 PI-37340 [0,2,0,0,0,0|0,0,0]=2 1252 B10R1.8 NC1=CC(OC)=CC(Cl)=C1 PI-36641 [0,2,0,0,0,0|1,0,0]=3 1253 B10R1.8 NNc1cc(Cl)cc(c1)Cl PI-29563 [0,2,0,0,0,0|2,0,0]=4 1254 B10R1.8 O=Cc1cc(Br)cc(c1)Br PI-18696 [0,2,0,0,0,0|1,0,1]=4 1255 B10R1.8 O=Cc1cc(C)cc(F)c1 PI-28945 [0,2,0,0,0,0|0,0,1]=3 1256 B10R1.8 O=Cc1cc(C)cc(c1)C PI-27730 [0,2,0,0,0,0|0,0,1]=3 1257 B10R1.8 O=Cc1cc(Cl)cc(Br)c1 PI-26240 [0,2,0,0,0,0|1,0,1]=4 1258 B10R1.8 O=Cc1cc(F)cc(c1)F PI-16921 [0,2,0,0,0,0|1,0,1]=4 1259 B10R1.8 O=Cc1cc(O)cc(O)c1 PI-11898 [0,2,0,0,0,0|0,0,1]=3 1260 B10R1.8 OC1=CC(C)=CC(OC)=C1 PI-20801 [0,2,0,0,0,0|0,0,0]=2 1261 B10R1.8 OCc1cc(Cl)cc(c1)Br PI-36975 [0,2,0,0,0,0|1,0,0]=3 1262 B10R1.8 OCc1cc(F)cc(c1)F PI-31311 [0,2,0,0,0,0|1,0,0]=3 1263 B10R1.8 OCc1cc(O)cc(O)c1 PI-31143 [0,2,0,0,0,0|0,0,0]=2 1264 B10R1.10 BrCCc1cccc(C)c1 PI-21424 [0,2,0,0,0,0|1,0,0]=3 1265 B10R1.10 BrCCc1cccc(Cl)c1 PI-21414 [0,2,0,0,0,0|1,0,0]=3 1266 B10R1.10 C1=CC(=CC(=C1)Br)C=NO PI-27659 [0,2,0,0,0,0|1,0,0]=3 1267 B10R1.10 C1=CC(=CC(=C1)Br)CCN PI-48226 [0,2,0,0,0,0|1,0,0]=3 1268 B10R1.10 C1=CC(=CC(=C1)Br)N=C=S PI-22498 [0,2,0,0,0,0|1,0,1]=4 1269 B10R1.10 C1=CC(=CC(=C1)Cl)C=NO PI-27977 [0,2,0,0,0,0|1,0,0]=3 1270 B10R1.10 C1=CC(=CC(=C1)F)CCBr PI-23811 [0,2,0,0,0,0|1,0,0]=3 1271 B10R1.10 C1=CC(=CC(=C1)F)N=C=O PI-19552 [0,2,0,0,0,0|1,0,1]=4 1272 B10R1.10 C1=CC(=CC(=C1)F)N=C=S PI-19553 [0,2,0,0,0,0|1,0,1]=4 1273 B10R1.10 C1=CC(=CC(=C1)O)CCN PI-12399 [0,2,0,0,0,0|0,0,0]=2 1274 B10R1.10 C1=CC(=CC(=C1)O)CCO PI-48194 [0,2,0,0,0,0|0,0,0]=2 1275 B10R1.10 CC1=CC(=CC=C1)N=C=O PI-50375 [0,2,0,0,0,0|0,0,1]=3 1276 B10R1.10 CCCC1=CC(=NC=C1)N PI-19769 [0,2,0,0,0,0|2,0,0]=4 1277 B10R1.10 CCOC1=CC(=CC=C1)F PI-33067 [0,2,0,0,0,0|1,0,0]=3 1278 B10R1.10 CCOC1=CC(=CC=C1)S PI-21359 [0,2,0,0,0,0|0,1,0]=3 1279 B10R1.10 CCOC1=NC=CC(=C1)N PI-31798 [0,2,0,0,0,0|2,0,0]=4 1280 B10R1.10 CCOc1cccc(c1)Br PI-38261 [0,2,0,0,0,0|1,0,0]=3 1281 B10R1.10 N#CCc1cccc(Cl)c1 PI-11917 [0,2,0,0,0,0|1,0,0]=3 1282 B10R1.10 N#CCc1cccc(F)c1 PI-16867 [0,2,0,0,0,0|1,0,0]=3 1283 B10R1.10 N#CCc1cccc(c1)Br PI-11912 [0,2,0,0,0,0|1,0,0]=3 1284 B10R1.10 NCCc1cccc(c1)F PI-33071 [0,2,0,0,0,0|1,0,0]=3 1285 B10R1.10 OCCc1cccc(c1)Cl PI-38594 [0,2,0,0,0,0|1,0,0]=3 1286 B10R1.10 [C-]#[N+]Cc1cccc(c1)Cl PI-23614 [0,2,0,0,0,0|1,0,0]=3 1287 B10R1.30 BrC1=C(C=C(C=C1)Cl)OC PI-41885 [0,2,0,0,0,0|1,0,0]=3 1288 B10R1.30 BrCc1cc(Cl)ccc1Cl PI-38192 [0,2,0,0,0,0|1,0,0]=3 1289 B10R1.30 BrCc1cc(Cl)ccc1F PI-20079 [0,2,0,0,0,0|1,0,0]=3 1290 B10R1.30 C1=C(Br)C=CC(=C1CO)O PI-12023 [0,2,0,0,0,0|1,0,0]=3 1291 B10R1.30 C1=C(C=NC(=C1CO)N)Br PI-34708 [0,2,0,0,0,0|2,0,0]=4 1292 B10R1.30 C1=C(Cl)C=CC(=C1C#N)F PI-28659 [0,2,0,0,0,0|1,0,1]=4 1293 B10R1.30 C1=C(Cl)C=CC(=C1C#N)N PI-11788 [0,2,0,0,0,0|1,0,1]=4 1294 B10R1.30 C1=CC(=C(C=C1Br)C#N)N PI-21368 [0,2,0,0,0,0|1,0,1]=4 1295 B10R1.30 C1=CC(=C(C=C1Br)C=O)Br PI-27892 [0,2,0,0,0,0|1,0,1]=4 1296 B10R1.30 C1=CC(=C(C=C1Br)C=O)Cl PI-33366 [0,2,0,0,0,0|1,0,1]=4 1297 B10R1.30 C1=CC(=C(C=C1Br)C=O)F PI-31330 [0,2,0,0,0,0|1,0,1]=4 1298 B10R1.30 C1=CC(=C(C=C1Br)C=O)O PI-29253 [0,2,0,0,0,0|1,0,1]=4 1299 B10R1.30 C1=CC(=C(C=C1Br)CN)N PI-44072 [0,2,0,0,0,0|1,0,0]=3 1300 B10R1.30 C1=CC(=C(C=C1Br)CO)F PI-14437 [0,2,0,0,0,0|1,0,0]=3 1301 B10R1.30 C1=CC(=C(C=C1Br)CO)N PI-46965 [0,2,0,0,0,0|1,0,0]=3 1302 B10R1.30 C1=CC(=C(C=C1Cl)C#N)Cl PI-11756 [0,2,0,0,0,0|1,0,1]=4 1303 B10R1.30 C1=CC(=C(C=C1Cl)C#N)O PI-44911 [0,2,0,0,0,0|1,0,1]=4 1304 B10R1.30 C1=CC(=C(C=C1Cl)C=O)Cl PI-16092 [0,2,0,0,0,0|1,0,1]=4 1305 B10R1.30 C1=CC(=C(C=C1Cl)C=O)F PI-10455 [0,2,0,0,0,0|1,0,1]=4 1306 B10R1.30 C1=CC(=C(C=C1Cl)C=O)O PI-12029 [0,2,0,0,0,0|1,0,1]=4 1307 B10R1.30 C1=CC(=C(C=C1Cl)CCl)Cl PI-27419 [0,2,0,0,0,0|1,0,0]=3 1308 B10R1.30 C1=CC(=C(C=C1Cl)CO)Cl PI-30501 [0,2,0,0,0,0|1,0,0]=3 1309 B10R1.30 C1=CC(=C(C=C1Cl)CO)O PI-12028 [0,2,0,0,0,0|1,0,0]=3 1310 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29450 [0,2,0,0,0,0|2,0,0]=4 1311 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29640 [0,2,0,0,0,0|2,0,0]=4 1312 B10R1.30 C1=CC(=C(C=C1F)C#N)Cl PI-28660 [0,2,0,0,0,0|1,0,1]=4 1313 B10R1.30 C1=CC(=C(C=C1F)C#N)F PI-28715 [0,2,0,0,0,0|1,0,1]=4 1314 B10R1.30 C1=CC(=C(C=C1F)C#N)N PI-10682 [0,2,0,0,0,0|1,0,1]=4 1315 B10R1.30 C1=CC(=C(C=C1F)C=O)Br PI-28896 [0,2,0,0,0,0|1,0,1]=4 1316 B10R1.30 C1=CC(=C(C=C1F)C=O)Cl PI-10456 [0,2,0,0,0,0|1,0,1]=4 1317 B10R1.30 C1=CC(=C(C=C1F)C=O)N PI-44253 [0,2,0,0,0,0|1,0,1]=4 1318 B10R1.30 C1=CC(=C(C=C1F)C=O)O PI-10579 [0,2,0,0,0,0|1,0,1]=4 1319 B10R1.30 C1=CC(=C(C=C1F)CBr)Br PI-14438 [0,2,0,0,0,0|1,0,0]=3 1320 B10R1.30 C1=CC(=C(C=C1F)CBr)Cl PI-34130 [0,2,0,0,0,0|1,0,0]=3 1321 B10R1.30 C1=CC(=C(C=C1F)CBr)F PI-13390 [0,2,0,0,0,0|1,0,0]=3 1322 B10R1.30 C1=CC(=C(C=C1F)CN)F PI-31317 [0,2,0,0,0,0|1,0,0]=3 1323 B10R1.30 C1=CC(=C(C=C1F)CO)Br PI-42946 [0,2,0,0,0,0|1,0,0]=3 1324 B10R1.30 C1=CC(=C(C=C1F)CO)F PI-33073 [0,2,0,0,0,0|1,0,0]=3 1325 B10R1.30 C1=CC(=C(C=C1F)NN)Cl PI-50546 [0,2,0,0,0,0|2,0,0]=4 1326 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-10633 [0,2,0,0,0,0|2,0,0]=4 1327 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-21223 [0,2,0,0,0,0|2,0,0]=4 1328 B10R1.30 C1=CC(=C(C=C1I)C#N)F PI-10697 [0,2,0,0,0,0|1,0,1]=4 1329 B10R1.30 C1=CC(=C(C=C1I)C=O)F PI-31572 [0,2,0,0,0,0|1,0,1]=4 1330 B10R1.30 C1=CC(=C(C=C1I)C=O)O PI-27272 [0,2,0,0,0,0|1,0,1]=4 1331 B10R1.30 C1=CC(=C(C=C1I)CO)Br PI-41207 [0,2,0,0,0,0|1,0,0]=3 1332 B10R1.30 C1=CC(=C(C=C1N)C#N)F PI-28621 [0,2,0,0,0,0|1,0,1]=4 1333 B10R1.30 CC1=C(C=C(C=C1)Cl)OC PI-10564 [0,2,0,0,0,0|1,0,0]=3 1334 B10R1.30 CC1=C(C=C(C=C1)F)C#N PI-28817 [0,2,0,0,0,0|1,0,1]=4 1335 B10R1.30 CC1=C(C=C(C=C1)F)C=O PI-10582 [0,2,0,0,0,0|1,0,1]=4 1336 B10R1.30 CC1=C(C=C(C=C1)F)CBr PI-23755 [0,2,0,0,0,0|1,0,0]=3 1337 B10R1.30 CC1=C(C=C(C=C1)F)NN PI-10636 [0,2,0,0,0,0|2,0,0]=4 1338 B10R1.30 CC1=CC(=C(C=C1)C)C#C PI-19877 [0,2,0,0,0,0|1,0,0]=3 1339 B10R1.30 CC1=CC(=C(C=C1)C)C#N PI-23423 [0,2,0,0,0,0|1,0,0]=3 1340 B10R1.30 CC1=CC(=C(C=C1)C)C=O PI-27729 [0,2,0,0,0,0|0,0,1]=3 1341 B10R1.30 CC1=CC(=C(C=C1)C)NN PI-29706 [0,2,0,0,0,0|1,0,0]=3 1342 B10R1.30 CC1=CC(=C(C=C1)F)C#N PI-28713 [0,2,0,0,0,0|1,0,0]=3 1343 B10R1.30 CC1=CC(=C(C=C1)F)C=O PI-10457 [0,2,0,0,0,0|0,0,1]=3 1344 B10R1.30 CC1=CC(=C(C=C1)N)C#N PI-34275 [0,2,0,0,0,0|1,0,0]=3 1345 B10R1.30 CC1=CC=C(O)C(CC)=N1 PI-33202 [0,2,0,0,0,0|2,0,0]=4 1346 B10R1.30 CC1=NC(=C(C=C1)F)OC PI-34436 [0,2,0,0,0,0|1,0,0]=3 1347 B10R1.30 CC1=NC(=C(C=C1)N)NC PI-35679 [0,2,0,0,0,0|2,0,0]=4 1348 B10R1.30 CCC1=C(C=CC(=C1)O)O PI-19340 [0,2,0,0,0,0|0,0,0]=2 1349 B10R1.30 CCc1cc(Br)ccc1I PI-21420 [0,2,0,0,0,0|1,0,0]=3 1350 B10R1.30 CNC1=C(C=CC(=C1)F)Br PI-39646 [0,2,0,0,0,0|1,0,0]=3 1351 B10R1.30 COC1=C(C=CC(=C1)Br)N PI-44941 [0,2,0,0,0,0|1,0,0]=3 1352 B10R1.30 COC1=C(C=CC(=C1)Cl)Cl PI-21000 [0,2,0,0,0,0|1,0,0]=3 1353 B10R1.30 COC1=C(C=CC(=C1)Cl)N PI-11332 [0,2,0,0,0,0|1,0,0]=3 1354 B10R1.30 COC1=C(C=CC(=C1)F)Br PI-21434 [0,2,0,0,0,0|1,0,0]=3 1355 B10R1.30 COC1=C(C=CC(=C1)F)F PI-12727 [0,2,0,0,0,0|1,0,0]=3 1356 B10R1.30 COC1=C(C=CC(=C1)N)Br PI-33359 [0,2,0,0,0,0|1,0,0]=3 1357 B10R1.30 COC1=C(C=CC(=C1)N)Cl PI-34236 [0,2,0,0,0,0|1,0,0]=3 1358 B10R1.30 COC1=C(C=CC(=C1)N)F PI-10622 [0,2,0,0,0,0|1,0,0]=3 1359 B10R1.30 COC1=C(N=CC(=C1)Br)N PI-34882 [0,2,0,0,0,0|2,0,0]=4 1360 B10R1.30 COC1=C(O)C=CC(F)=C1 PI-27601 [0,2,0,0,0,0|1,0,0]=3 1361 B10R1.30 COC1=CC(=CN=C1F)Br PI-43260 [0,2,0,0,0,0|2,0,0]=4 1362 B10R1.30 COC1=CC(Br)=CN=C1Cl PI-41978 [0,2,0,0,0,0|2,0,0]=4 1363 B10R1.30 COc1cc(Br)ccc1Cl PI-14389 [0,2,0,0,0,0|1,0,0]=3 1364 B10R1.30 COc1cc(Br)ccc1F PI-34341 [0,2,0,0,0,0|1,0,0]=3 1365 B10R1.30 FC1=CC(=C(N)C=C1)OC PI-39749 [0,2,0,0,0,0|1,0,0]=3 1366 B10R1.30 N#Cc1cc(Br)ccc1Cl PI-35251 [0,2,0,0,0,0|1,0,1]=4 1367 B10R1.30 N#Cc1cc(Br)ccc1F PI-16380 [0,2,0,0,0,0|1,0,1]=4 1368 B10R1.30 N#Cc1cc(Br)ccc1O PI-21509 [0,2,0,0,0,0|1,0,1]=4 1369 B10R1.30 N#Cc1cc(Cl)ccc1Br PI-38901 [0,2,0,0,0,0|1,0,1]=4 1370 B10R1.30 N#Cc1cc(F)ccc1Br PI-10686 [0,2,0,0,0,0|1,0,1]=4 1371 B10R1.30 N#Cc1cc(N)ccc1N PI-17238 [0,2,0,0,0,0|1,0,1]=4 1372 B10R1.30 N#Cc1cc(O)ccc1F PI-39223 [0,2,0,0,0,0|0,0,1]=3 1373 B10R1.30 NCc1cc(Cl)ccc1F PI-20075 [0,2,0,0,0,0|1,0,0]=3 1374 B10R1.30 NNC1=CC(Br)=CC=C1C PI-39726 [0,2,0,0,0,0|2,0,0]=4 1375 B10R1.30 O=CC1=CC(Br)=CC=C1N PI-46730 [0,2,0,0,0,0|1,0,1]=4 1376 B10R1.30 O=Cc1cc(Br)ccc1I PI-26850 [0,2,0,0,0,0|1,0,1]=4 1377 B10R1.30 O=Cc1cc(C)ccc1O PI-10857 [0,2,0,0,0,0|0,0,1]=3 1378 B10R1.30 O=Cc1cc(Cl)ccc1Br PI-33350 [0,2,0,0,0,0|1,0,1]=4 1379 B10R1.30 O=Cc1cc(Cl)ccc1N PI-18302 [0,2,0,0,0,0|1,0,1]=4 1380 B10R1.30 O=Cc1cc(F)ccc1F PI-10418 [0,2,0,0,0,0|1,0,1]=4 1381 B10R1.30 O=Cc1cc(O)ccc1Br PI-27441 [0,2,0,0,0,0|0,0,1]=3 1382 B10R1.30 O=Cc1cc(O)ccc1O PI-18118 [0,2,0,0,0,0|0,0,1]=3 1383 B10R1.30 OC1=CC=C(C)N=C1CC PI-40313 [0,2,0,0,0,0|2,0,0]=4 1384 B10R1.30 OCc1cc(Cl)ccc1Br PI-35234 [0,2,0,0,0,0|1,0,0]=3 1385 B10R1.113 B(C1=CC(=CC=C1)Br)(O)O PI-25960 [0,2,0,0,0,0|1,0,0]=3 1386 B10R1.113 B(C1=CC(=CC=C1)C)(O)O PI-11574 [0,2,0,0,0,0|0,0,0]=2 1387 B10R1.113 B(C1=CC(=CC=C1)N)(O)O PI-25874 [0,2,0,0,0,0|1,0,0]=3 1388 B10R1.113 B(C1=CC(=CC=C1)N)(O)O PI-30837 [0,2,0,0,0,0|1,0,0]=3 1389 B10R1.113 B(C1=CC(=CC=C1)O)(O)O PI-25936 [0,2,0,0,0,0|1,0,0]=3 1390 B10R1.113 B(C1=CC(=CN=C1)Br)(O)O PI-25584 [0,2,0,0,0,0|2,0,0]=4 1391 B10R1.113 B(C1=CC(=CN=C1)C)(O)O PI-25250 [0,2,0,0,0,0|1,0,0]=3 1392 B10R1.113 B(C1=CC(=NC=C1)Cl)(O)O PI-25586 [0,2,0,0,0,0|2,0,0]=4 1393 B10R1.113 B(C1=NC(=CC=C1)Br)(O)O PI-33786 [0,2,0,0,0,0|2,0,0]=4 1394 B10R1.113 B(C1=NC=CC(=C1)C)(O)O PI-25498 [0,2,0,0,0,0|1,0,0]=3 1395 B10R1.113 Brc1cccc(c1)C(=N)N PI-30204 [0,2,0,0,0,0|1,0,1]=4 1396 B10R1.113 Brc1cccc(c1)C(=O)Cl PI-11911 [0,2,0,0,0,0|1,0,1]=4 1397 B10R1.113 Brc1cccc(c1)C(=O)O PI-12741 [0,2,0,0,0,0|1,0,0]=3 1398 B10R1.113 Brc1cccc(c1)C(N)C PI-34608 [0,2,0,0,0,0|1,0,0]=3 1399 B10R1.113 Brc1cccc(c1)[C@@H](N)C PI-34607 [0,2,0,0,0,0|1,0,0]=3 1400 B10R1.113 Brc1cccc(c1)[N+](=O)[O-] PI-13640 [0,2,0,0,0,0|1,0,1]=4 1401 B10R1.113 Brc1cccc(n1)C(=O)O PI-16042 [0,2,0,0,0,0|2,0,0]=4 1402 B10R1.113 Brc1nccc(c1)C(=O)O PI-28742 [0,2,0,0,0,0|2,0,0]=4 1403 B10R1.113 C1=C(C=NC=C1Br)C(=O)O PI-22834 [0,2,0,0,0,0|2,0,0]=4 1404 B10R1.113 C1=C(C=NC=C1Cl)C(=O)O PI-13096 [0,2,0,0,0,0|2,0,0]=4 1405 B10R1.113 C1=C(C=NC=C1F)C(=O)O PI-19548 [0,2,0,0,0,0|2,0,0]=4 1406 B10R1.113 C1=C(C=NC=C1N)C(=O)O PI-10028 [0,2,0,0,0,0|2,0,0]=4 1407 B10R1.113 C1=CC(=CC(=C1)Br)C(=S)N PI-22613 [0,2,0,0,0,0|1,0,1]=4 1408 B10R1.113 C1=CC(=CC(=C1)Br)C(F)F PI-21635 [0,2,0,0,0,0|1,0,0]=3 1409 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)Cl PI-12189 [0,2,0,0,0,0|1,0,1]=4 1410 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)N PI-23129 [0,2,0,0,0,0|1,0,1]=4 1411 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)O PI-34230 [0,2,0,0,0,0|1,0,0]=3 1412 B10R1.113 C1=CC(=CC(=C1)Cl)C(=S)N PI-15665 [0,2,0,0,0,0|1,0,1]=4 1413 B10R1.113 C1=CC(=CC(=C1)Cl)C(Cl)Cl PI-19154 [0,2,0,0,0,0|1,0,0]=3 1414 B10R1.113 C1=CC(=CC(=C1)F)C(=O)Cl PI-12124 [0,2,0,0,0,0|1,0,1]=4 1415 B10R1.113 C1=CC(=CC(=C1)F)C(=O)O PI-10427 [0,2,0,0,0,0|1,0,0]=3 1416 B10R1.113 C1=CC(=CC(=C1)F)C(=O)[O-] PI-28584 [0,2,0,0,0,0|1,0,1]=4 1417 B10R1.113 C1=CC(=CC(=C1)F)C(Cl)Cl PI-19546 [0,2,0,0,0,0|1,0,0]=3 1418 B10R1.113 C1=CC(=NC(=C1)N)C(=O)O PI-24258 [0,2,0,0,0,0|2,0,0]=4 1419 B10R1.113 C1=CN=C(C=C1Br)C(=O)O PI-35911 [0,2,0,0,0,0|2,0,0]=4 1420 B10R1.113 C1=CN=C(C=C1C(=O)O)Cl PI-16713 [0,2,0,0,0,0|2,0,0]=4 1421 B10R1.113 C1=CN=C(C=C1C(=O)O)N PI-28116 [0,2,0,0,0,0|2,0,0]=4 1422 B10R1.113 C1=CN=C(C=C1Cl)C(=O)O PI-34707 [0,2,0,0,0,0|2,0,0]=4 1423 B10R1.113 C1=CNC(=CC1=O)C(=O)O PI-34877 [0,2,0,0,0,0|2,0,0]=4 1424 B10R1.113 C1=CNC(=O)C=C1C(=O)O PI-28282 [0,2,0,0,0,0|2,0,0]=4 1425 B10R1.113 CC(=O)C1=CC(=CC=C1)I PI-29141 [0,2,0,0,0,0|1,0,0]=3 1426 B10R1.113 CC(=O)C1=CC(=CN=C1)Br PI-26605 [0,2,0,0,0,0|2,0,0]=4 1427 B10R1.113 CC(C)C1=NC(=CC=C1)Cl PI-31678 [0,2,0,0,0,0|2,0,0]=4 1428 B10R1.113 CC(C1=CC(=CC=C1)Br)O PI-19679 [0,2,0,0,0,0|1,0,0]=3 1429 B10R1.113 CC(C1=CC(=CC=C1)Cl)O PI-32583 [0,2,0,0,0,0|1,0,0]=3 1430 B10R1.113 CC(C1=CC(=CC=C1)F)N PI-34605 [0,2,0,0,0,0|1,0,0]=3 1431 B10R1.113 CC(C1=CC(=CC=C1)F)N PI-34606 [0,2,0,0,0,0|1,0,0]=3 1432 B10R1.113 CC(C1=CC(=CC=C1)F)O PI-32581 [0,2,0,0,0,0|1,0,0]=3 1433 B10R1.113 CC1=CC(=CC=C1)C(=N)N PI-30283 [0,2,0,0,0,0|1,0,0]=3 1434 B10R1.113 CC1=CC(=CC=C1)C(=O)C PI-10859 [0,2,0,0,0,0|0,0,1]=3 1435 B10R1.113 CC1=CC(=CC=C1)N(C)N PI-29882 [0,2,0,0,0,0|1,0,0]=3 1436 B10R1.113 CC1=CC(=CC=C1)[C@@H](C)O PI-49835 [0,2,0,0,0,0|0,0,0]=2 1437 B10R1.113 CC1=CC(=CN=C1)C(=O)O PI-13102 [0,2,0,0,0,0|1,0,0]=3 1438 B10R1.113 CC1=NC(=CC=C1)C(=O)O PI-31796 [0,2,0,0,0,0|1,0,0]=3 1439 B10R1.113 CC1=NC(=CC=C1)[N+](=O)[O-] PI-28224 [0,2,0,0,0,0|1,0,1]=4 1440 B10R1.113 CC1=NC=CC(C(C)=O)=C1 PI-46770 [0,2,0,0,0,0|1,0,1]=4 1441 B10R1.113 C[C@@H](C1=CC(=CC=C1)Br)O PI-49804 [0,2,0,0,0,0|1,0,0]=3 1442 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 PI-37056 [0,2,0,0,0,0|1,0,0]=3 1443 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)N PI-17447 [0,2,0,0,0,0|1,0,1]=4 1444 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)O PI-17996 [0,2,0,0,0,0|1,0,0]=3 1445 B10R1.113 C[n+]1cccc(c1)C(=O)[O-] PI-39076 [0,2,0,0,0,0|1,0,1]=4 1446 B10R1.113 Cc1cccc(n1)B(O)O PI-25500 [0,2,0,0,0,0|1,0,0]=3 1447 B10R1.113 Cc1nccc(n1)C(=O)O PI-36794 [0,2,0,0,0,0|2,0,0]=4 1448 B10R1.113 Clc1cccc(c1)B(O)O PI-11573 [0,2,0,0,0,0|1,0,0]=3 1449 B10R1.113 Clc1cccc(c1)[C@@H](N)C PI-34603 [0,2,0,0,0,0|1,0,0]=3 1450 B10R1.113 Clc1cccc(c1)[C@H](N)C PI-34604 [0,2,0,0,0,0|1,0,0]=3 1451 B10R1.113 Clc1cccc(n1)C(=O)O PI-10178 [0,2,0,0,0,0|2,0,0]=4 1452 B10R1.113 Clc1cncc(c1)B(O)O PI-25937 [0,2,0,0,0,0|2,0,0]=4 1453 B10R1.113 Clc1nccc(c1)C(=O)C PI-38296 [0,2,0,0,0,0|2,0,0]=4 1454 B10R1.113 Fc1cccc(c1)B(O)O PI-23443 [0,2,0,0,0,0|1,0,0]=3 1455 B10R1.113 Fc1cccc(c1)C(=O)C PI-28549 [0,2,0,0,0,0|1,0,0]=3 1456 B10R1.113 Fc1cccc(c1)[N+](=O)[O-] PI-16966 [0,2,0,0,0,0|1,0,1]=4 1457 B10R1.113 Fc1cccc(n1)C(=O)O PI-34433 [0,2,0,0,0,0|2,0,0]=4 1458 B10R1.113 Fc1nccc(c1)B(O)O PI-25543 [0,2,0,0,0,0|2,0,0]=4 1459 B10R1.113 Fc1nccc(c1)C(=O)O PI-19547 [0,2,0,0,0,0|2,0,0]=4 1460 B10R1.113 Ic1cccc(c1)C(=O)O PI-12091 [0,2,0,0,0,0|1,0,0]=3 1461 B10R1.113 Ic1nccc(c1)C(=O)O PI-36519 [0,2,0,0,0,0|2,0,0]=4 1462 B10R1.113 NC(C1=CC=CC(O)=C1)=S PI-20876 [0,2,0,0,0,0|0,0,1]=3 1463 B10R1.113 Nc1cccc(c1)B(O)O PI-16837 [0,2,0,0,0,0|1,0,0]=3 1464 B10R1.113 Nc1cccc(c1)C(=O)C PI-32567 [0,2,0,0,0,0|1,0,0]=3 1465 B10R1.113 Nc1cccc(c1)C(=O)N PI-30514 [0,2,0,0,0,0|1,0,1]=4 1466 B10R1.113 Nc1cccc(c1)N(C)C PI-30522 [0,2,0,0,0,0|1,0,0]=3 1467 B10R1.113 O=C(C1=CC(C)=NC=C1)O PI-36276 [0,2,0,0,0,0|1,0,0]=3 1468 B10R1.113 O=C(C1=CC(C=CO1)=O)O PI-40052 [0,2,0,0,0,0|2,0,0]=4 1469 B10R1.113 OC(=O)c1cccc(O)n1 PI-16038 [0,2,0,0,0,0|1,0,1]=4 1470 B10R1.113 Oc1cccc(c1)C(=O)C PI-31363 [0,2,0,0,0,0|0,0,0]=2 1471 B10R1.113 Oc1cccc(c1)C(=O)N PI-30785 [0,2,0,0,0,0|0,0,1]=3 1472 B10R1.113 Oc1cccc(c1)C(=O)O PI-33399 [0,2,0,0,0,0|0,0,1]=3 1473 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] PI-11942 [0,2,0,0,0,0|1,0,0]=3 1474 B10R1.113 Oc1cncc(c1)C(=O)O PI-10172 [0,2,0,0,0,0|1,0,1]=4 1475 B10R1.113 S=C(N)C1=CC=CC(C)=C1 PI-19344 [0,2,0,0,0,0|0,1,0]=3 1476 B10R1.113 Sc1cccc(c1)N(C)C PI-23411 [0,2,0,0,0,0|0,1,0]=3 1477 B10R1.113 [O-][N+](=O)c1cc(C)ccn1 PI-28226 [0,2,0,0,0,0|1,0,1]=4 1478 B10R1.172 BrCC1=CC(CBr)=CC=C1 PI-32198 [0,2,0,0,0,0|1,0,0]=3 1479 B10R1.172 BrCc1cccc(C=O)c1 PI-26927 [0,2,0,0,0,0|0,0,1]=3 1480 B10R1.172 C1=CC(=CC(=C1)C#N)C#N PI-48850 [0,2,0,0,0,0|1,0,1]=4 1481 B10R1.172 C1=CC(=CC(=C1)C#N)C=O PI-24269 [0,2,0,0,0,0|0,0,2]=4 1482 B10R1.172 C1=CC(=CC(=C1)C#N)CBr PI-11546 [0,2,0,0,0,0|1,0,0]=3 1483 B10R1.172 C1=CC(=CC(=C1)C#N)CO PI-46956 [0,2,0,0,0,0|0,0,1]=3 1484 B10R1.172 C1=CC(=CC(=C1)CO)CO PI-11678 [0,2,0,0,0,0|0,0,0]=2 1485 B10R1.172 C1=CC(=CC(=C1)NN)C#N PI-44884 [0,2,0,0,0,0|1,0,1]=4 1486 B10R1.172 C1=CC(=CC(=C1)NN)C#N PI-44909 [0,2,0,0,0,0|1,0,1]=4 1487 B10R1.172 C1=CC(=CC(=C1)NN)C#N PI-50325 [0,2,0,0,0,0|1,0,1]=4 1488 B10R1.172 C1=CC(=NC(=C1)CCl)CCl PI-46996 [0,2,0,0,0,0|2,0,0]=4 1489 B10R1.172 C=Cc1cccc(c1)C=O PI-27316 [0,2,0,0,0,0|0,0,2]=4 1490 B10R1.172 CCC1=CC(=CC=C1)C#N PI-22051 [0,2,0,0,0,0|1,0,0]=3 1491 B10R1.172 CCC1=NC=CC(=C1)C#N PI-44125 [0,2,0,0,0,0|2,0,0]=4 1492 B10R1.172 CNC1=NC(=CC=C1)OC PI-11646 [0,2,0,0,0,0|1,0,0]=3 1493 B10R1.172 COC1=CC(=CC=C1)OC PI-35273 [0,2,0,0,0,0|0,0,0]=2 1494 B10R1.172 COC1=CC(=NC=C1)CN PI-50083 [0,2,0,0,0,0|1,0,0]=3 1495 B10R1.172 COC1=CC(=NC=C1)OC PI-26237 [0,2,0,0,0,0|1,0,0]=3 1496 B10R1.172 COC1=CC(=NC=N1)OC PI-21332 [0,2,0,0,0,0|2,0,0]=4 1497 B10R1.172 COC1=CC=CC(=C1)C#N PI-31072 [0,2,0,0,0,0|0,0,1]=3 1498 B10R1.172 COC1=CC=CC(=C1)CBr PI-49400 [0,2,0,0,0,0|0,0,0]=2 1499 B10R1.172 COC1=CC=CC(=C1)CN PI-31714 [0,2,0,0,0,0|0,0,0]=2 1500 B10R1.172 COC1=CC=CC(=C1)NN PI-29546 [0,2,0,0,0,0|1,0,0]=3 1501 B10R1.172 COC1=NC(=CC=C1)OC PI-34404 [0,2,0,0,0,0|1,0,0]=3 1502 B10R1.172 COC1=NC(=NC=C1)OC PI-21327 [0,2,0,0,0,0|2,0,0]=4 1503 B10R1.172 COc1cccc(c1)C=O PI-32570 [0,2,0,0,0,0|0,0,1]=3 1504 B10R1.172 COc1cccc(n1)C=O PI-26723 [0,2,0,0,0,0|1,0,1]=4 1505 B10R1.172 COc1nccc(c1)CO PI-39370 [0,2,0,0,0,0|1,0,0]=3 1506 B10R1.172 ClCc1cccc(c1)OC PI-32021 [0,2,0,0,0,0|0,0,0]=2 1507 B10R1.172 N#CC1=NC(OC)=CC=C1 PI-46677 [0,2,0,0,0,0|1,0,1]=4 1508 B10R1.172 N#CC1=NC=CC(OC)=C1 PI-46678 [0,2,0,0,0,0|1,0,1]=4 1509 B10R1.172 O=CC1=CC(OC)=CN=C1 PI-37016 [0,2,0,0,0,0|1,0,1]=4 1510 B10R1.172 O=Cc1cccc(c1)C=O PI-16456 [0,2,0,0,0,0|0,0,2]=4 1511 B10R1.172 O=Cc1cccc(c1)C=O PI-18771 [0,2,0,0,0,0|0,0,2]=4 1512 B10R1.172 OCc1cccc(CBr)c1 PI-22137 [0,2,0,0,0,0|0,0,0]=2 1513 B10R1.172 OCc1cccc(c1)OC PI-31272 [0,2,0,0,0,0|0,0,0]=2 1514 B10R1.172 OCc1cccc(n1)CO PI-10381 [0,2,0,0,0,0|1,0,0]=3 1515 B10R1.176 BrC1=C(C=C(C#N)C=C1)F PI-10688 [0,2,0,0,0,0|1,0,1]=4 1516 B10R1.176 BrCc1ccc(C)c(F)c1 PI-23753 [0,2,0,0,0,0|1,0,0]=3 1517 B10R1.176 BrCc1ccc(F)c(C)c1 PI-23754 [0,2,0,0,0,0|1,0,0]=3 1518 B10R1.176 C1=C(C=CC(=C1F)Cl)C#N PI-28050 [0,2,0,0,0,0|1,0,1]=4 1519 B10R1.176 C1=C(C=CC(=C1F)F)C#N PI-16869 [0,2,0,0,0,0|1,0,1]=4 1520 B10R1.176 C1=CC(=C(C=C1C#N)Br)O PI-16222 [0,2,0,0,0,0|1,0,1]=4 1521 B10R1.176 C1=CC(=C(C=C1C#N)F)I PI-10700 [0,2,0,0,0,0|1,0,1]=4 1522 B10R1.176 C1=CC(=C(C=C1C#N)F)N PI-10683 [0,2,0,0,0,0|1,0,1]=4 1523 B10R1.176 C1=CC(=C(C=C1C#N)F)O PI-34365 [0,2,0,0,0,0|1,0,1]=4 1524 B10R1.176 C1=CC(=C(C=C1C#N)N)F PI-34256 [0,2,0,0,0,0|1,0,1]=4 1525 B10R1.176 C1=CC(=C(C=C1C#N)O)F PI-35270 [0,2,0,0,0,0|0,0,1]=3 1526 B10R1.176 C1=CC(=C(C=C1C=O)Br)Br PI-27885 [0,2,0,0,0,0|1,0,1]=4 1527 B10R1.176 C1=CC(=C(C=C1C=O)Br)Cl PI-35233 [0,2,0,0,0,0|1,0,1]=4 1528 B10R1.176 C1=CC(=C(C=C1C=O)Br)O PI-18445 [0,2,0,0,0,0|1,0,1]=4 1529 B10R1.176 C1=CC(=C(C=C1C=O)Cl)F PI-28406 [0,2,0,0,0,0|1,0,1]=4 1530 B10R1.176 C1=CC(=C(C=C1C=O)Cl)O PI-20127 [0,2,0,0,0,0|1,0,1]=4 1531 B10R1.176 C1=CC(=C(C=C1C=O)F)O PI-28509 [0,2,0,0,0,0|1,0,1]=4 1532 B10R1.176 C1=CC(=C(C=C1C=O)I)F PI-26322 [0,2,0,0,0,0|1,0,1]=4 1533 B10R1.176 C1=CC(=C(C=C1C=O)O)I PI-27146 [0,2,0,0,0,0|0,0,1]=3 1534 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl PI-35255 [0,2,0,0,0,0|1,0,0]=3 1535 B10R1.176 C1=CC(=C(C=C1CBr)Cl)F PI-20078 [0,2,0,0,0,0|1,0,0]=3 1536 B10R1.176 C1=CC(=C(C=C1CBr)F)Br PI-35170 [0,2,0,0,0,0|1,0,0]=3 1537 B10R1.176 C1=CC(=C(C=C1CBr)F)F PI-13391 [0,2,0,0,0,0|1,0,0]=3 1538 B10R1.176 C1=CC(=C(C=C1CCl)F)F PI-21150 [0,2,0,0,0,0|1,0,0]=3 1539 B10R1.176 C1=CC(=C(C=C1CN)Br)F PI-43947 [0,2,0,0,0,0|1,0,0]=3 1540 B10R1.176 C1=CC(=C(C=C1CN)Cl)Cl PI-11886 [0,2,0,0,0,0|1,0,0]=3 1541 B10R1.176 C1=CC(=C(C=C1CN)Cl)F PI-20074 [0,2,0,0,0,0|1,0,0]=3 1542 B10R1.176 C1=CC(=C(C=C1CN)F)F PI-33741 [0,2,0,0,0,0|1,0,0]=3 1543 B10R1.176 C1=CC(=C(C=C1CO)Br)F PI-14435 [0,2,0,0,0,0|1,0,0]=3 1544 B10R1.176 C1=CC(=C(C=C1CO)Cl)Cl PI-32224 [0,2,0,0,0,0|1,0,0]=3 1545 B10R1.176 C1=CC(=C(C=C1CO)O)I PI-45003 [0,2,0,0,0,0|0,0,0]=2 1546 B10R1.176 C1=CC(=C(C=C1CO)O)O PI-19526 [0,2,0,0,0,0|0,0,0]=2 1547 B10R1.176 C1=CC(=C(C=C1NN)Cl)F PI-20108 [0,2,0,0,0,0|2,0,0]=4 1548 B10R1.176 C1=CC(=C(C=C1NN)Cl)F PI-20109 [0,2,0,0,0,0|2,0,0]=4 1549 B10R1.176 C1=CC(=C(C=C1NN)F)F PI-31188 [0,2,0,0,0,0|2,0,0]=4 1550 B10R1.176 CC1=C(C=C(C=C1)C#N)Cl PI-20153 [0,2,0,0,0,0|1,0,1]=4 1551 B10R1.176 CC1=C(C=C(C=C1)C#N)F PI-31087 [0,2,0,0,0,0|1,0,1]=4 1552 B10R1.176 CC1=C(C=C(C=C1)C=O)C PI-11614 [0,2,0,0,0,0|0,0,1]=3 1553 B10R1.176 CC1=C(C=C(C=C1)C=O)F PI-28215 [0,2,0,0,0,0|1,0,1]=4 1554 B10R1.176 CC1=C(C=C(C=C1)CCl)C PI-23827 [0,2,0,0,0,0|1,0,0]=3 1555 B10R1.176 CC1=C(C=C(C=C1)CN)C PI-33680 [0,2,0,0,0,0|1,0,0]=3 1556 B10R1.176 CC1=C(C=C(C=C1)CN)Cl PI-20155 [0,2,0,0,0,0|1,0,0]=3 1557 B10R1.176 CC1=C(C=C(C=C1)NN)C PI-50516 [0,2,0,0,0,0|1,0,0]=3 1558 B10R1.176 CC1=C(C=C(C=C1)NN)Cl PI-20172 [0,2,0,0,0,0|2,0,0]=4 1559 B10R1.176 CC1=C(C=C(C=C1)OC)Cl PI-10076 [0,2,0,0,0,0|1,0,0]=3 1560 B10R1.176 CC1=C(C=C(C=C1)OC)F PI-28510 [0,2,0,0,0,0|1,0,0]=3 1561 B10R1.176 CC1=C(C=CC(=C1)C#N)Br PI-14470 [0,2,0,0,0,0|1,0,0]=3 1562 B10R1.176 CC1=C(C=CC(=C1)C#N)F PI-10709 [0,2,0,0,0,0|1,0,0]=3 1563 B10R1.176 CC1=C(C=CC(=C1)C#N)N PI-30932 [0,2,0,0,0,0|1,0,0]=3 1564 B10R1.176 CC1=C(C=CC(=C1)C=O)F PI-28124 [0,2,0,0,0,0|0,0,1]=3 1565 B10R1.176 CC1=C(C=CC(=C1)C=O)O PI-18215 [0,2,0,0,0,0|0,0,1]=3 1566 B10R1.176 CC1=C(C=CC(=C1)OC)Br PI-31134 [0,2,0,0,0,0|0,0,0]=2 1567 B10R1.176 CC1=C(C=CC(=C1)OC)Cl PI-19110 [0,2,0,0,0,0|0,0,0]=2 1568 B10R1.176 CC1=C(C=CC(=C1)OC)F PI-28300 [0,2,0,0,0,0|0,0,0]=2 1569 B10R1.176 CC1=C(C=CC(=C1)OC)N PI-11298 [0,2,0,0,0,0|0,0,0]=2 1570 B10R1.176 CC1=NC(OC)=NC=C1Br PI-46809 [0,2,0,0,0,0|2,0,0]=4 1571 B10R1.176 CCc1ccc(c(c1)O)O PI-19057 [0,2,0,0,0,0|0,0,0]=2 1572 B10R1.176 COC1=CC(=C(C=C1)Br)Cl PI-20604 [0,2,0,0,0,0|1,0,0]=3 1573 B10R1.176 COC1=CC(=C(C=C1)Br)F PI-10453 [0,2,0,0,0,0|1,0,0]=3 1574 B10R1.176 COC1=CC(=C(C=C1)Cl)Br PI-33016 [0,2,0,0,0,0|1,0,0]=3 1575 B10R1.176 COC1=CC(=C(C=C1)N)O PI-34837 [0,2,0,0,0,0|0,0,0]=2 1576 B10R1.176 COC1=CC(=C(C=C1)O)Br PI-14462 [0,2,0,0,0,0|1,0,0]=3 1577 B10R1.176 COC1=CC(=C(C=C1)O)N PI-34807 [0,2,0,0,0,0|1,0,0]=3 1578 B10R1.176 COC1=CC(F)=C(O)C=C1 PI-40578 [0,2,0,0,0,0|1,0,0]=3 1579 B10R1.176 COC1=CC=C(Cl)C(F)=C1 PI-39520 [0,2,0,0,0,0|1,0,0]=3 1580 B10R1.176 COC1=CC=C(N)C(N)=C1 PI-12090 [0,2,0,0,0,0|1,0,0]=3 1581 B10R1.176 COC1=NC(=C(C=C1)N)N PI-10380 [0,2,0,0,0,0|2,0,0]=4 1582 B10R1.176 COC1=NC(=C(C=C1)N)N PI-33881 [0,2,0,0,0,0|2,0,0]=4 1583 B10R1.176 COc1ccc(c(c1)Cl)O PI-20143 [0,2,0,0,0,0|1,0,0]=3 1584 B10R1.176 COc1ccc(c(c1)F)F PI-28067 [0,2,0,0,0,0|1,0,0]=3 1585 B10R1.176 COc1ccc(c(c1)F)N PI-39131 [0,2,0,0,0,0|1,0,0]=3 1586 B10R1.176 COc1ccc(c(c1)N)Br PI-35266 [0,2,0,0,0,0|1,0,0]=3 1587 B10R1.176 COc1ccc(c(c1)N)N PI-29731 [0,2,0,0,0,0|1,0,0]=3 1588 B10R1.176 COc1ccc(c(n1)C)Br PI-38912 [0,2,0,0,0,0|1,0,0]=3 1589 B10R1.176 COc1ncc(c(c1)C)Br PI-38911 [0,2,0,0,0,0|1,0,0]=3 1590 B10R1.176 CSC1=CC(=C(C=C1)Cl)Cl PI-11888 [0,2,0,0,0,0|1,0,0]=3 1591 B10R1.176 Fc1ccc(C=O)cc1Br PI-10431 [0,2,0,0,0,0|1,0,1]=4 1592 B10R1.176 N#Cc1ccc(Cl)c(Cl)c1 PI-16133 [0,2,0,0,0,0|1,0,1]=4 1593 B10R1.176 N#Cc1ccc(F)c(Cl)c1 PI-16135 [0,2,0,0,0,0|1,0,1]=4 1594 B10R1.176 N#Cc1ccc(N)c(Br)c1 PI-30657 [0,2,0,0,0,0|1,0,1]=4 1595 B10R1.176 N#Cc1ccc(c(c1)Br)C PI-34358 [0,2,0,0,0,0|1,0,1]=4 1596 B10R1.176 N#Cc1ccc(c(c1)Br)Cl PI-38899 [0,2,0,0,0,0|1,0,1]=4 1597 B10R1.176 N#Cc1ccc(c(c1)Br)F PI-28834 [0,2,0,0,0,0|1,0,1]=4 1598 B10R1.176 N#Cc1ccc(c(c1)C)C PI-29364 [0,2,0,0,0,0|1,0,0]=3 1599 B10R1.176 N#Cc1ccc(c(c1)Cl)N PI-30322 [0,2,0,0,0,0|1,0,1]=4 1600 B10R1.176 N#Cc1ccc(c(c1)N)Cl PI-35250 [0,2,0,0,0,0|1,0,1]=4 1601 B10R1.176 N#Cc1ccc(c(c1)N)N PI-20945 [0,2,0,0,0,0|1,0,1]=4 1602 B10R1.176 NCc1ccc(c(c1)O)O PI-30190 [0,2,0,0,0,0|0,0,0]=2 1603 B10R1.176 NNc1ccc(Cl)c(Cl)c1 PI-29297 [0,2,0,0,0,0|2,0,0]=4 1604 B10R1.176 NNc1ccc(F)c(F)c1 PI-31079 [0,2,0,0,0,0|2,0,0]=4 1605 B10R1.176 NNc1ccc(c(c1)C)C PI-29749 [0,2,0,0,0,0|1,0,0]=3 1606 B10R1.176 O=CC1=CC=C(O)C(I)=C1 PI-27762 [0,2,0,0,0,0|1,0,1]=4 1607 B10R1.176 O=Cc1ccc(Cl)c(F)c1 PI-10524 [0,2,0,0,0,0|1,0,1]=4 1608 B10R1.176 O=Cc1ccc(F)c(F)c1 PI-10106 [0,2,0,0,0,0|1,0,1]=4 1609 B10R1.176 O=Cc1ccc(I)c(F)c1 PI-28941 [0,2,0,0,0,0|1,0,1]=4 1610 B10R1.176 O=Cc1ccc(I)c(I)c1 PI-26672 [0,2,0,0,0,0|1,0,1]=4 1611 B10R1.176 O=Cc1ccc(O)c(O)c1 PI-10046 [0,2,0,0,0,0|0,0,1]=3 1612 B10R1.176 O=Cc1ccc(c(c1)Cl)Cl PI-18774 [0,2,0,0,0,0|1,0,1]=4 1613 B10R1.176 O=Cc1ccc(c(c1)F)Br PI-10449 [0,2,0,0,0,0|1,0,1]=4 1614 B10R1.176 O=Cc1ccc(c(c1)O)C PI-27720 [0,2,0,0,0,0|0,0,1]=3 1615 B10R1.176 OCc1ccc(c(c1)F)Br PI-39169 [0,2,0,0,0,0|1,0,0]=3 1616 B10R1.176 OCc1occ(c(=O)c1)O PI-37271 [0,2,0,0,0,0|1,0,1]=4 1617 B10R1.22 Brc1cc(Br)c(C)c(Br)c1 PI-37333 [0,2,0,0,0,0|2,0,0]=4 1618 B10R1.22 Brc1cc(C)c(c(c1)C)F PI-21493 [0,2,0,0,0,0|1,0,0]=3 1619 B10R1.22 Brc1cc(F)c(c(c1)F)F PI-16884 [0,2,0,0,0,0|2,0,0]=4 1620 B10R1.22 Brc1cc(F)c(c(c1)F)N PI-31264 [0,2,0,0,0,0|2,0,0]=4 1621 B10R1.22 Brc1cc(F)c(c(c1)F)O PI-14413 [0,2,0,0,0,0|2,0,0]=4 1622 B10R1.22 C1=C(C=C(C(=C1Br)Br)Br)F PI-19734 [0,2,0,0,0,0|2,0,0]=4 1623 B10R1.22 C1=C(C=C(C(=C1Br)Cl)Br)Cl PI-45728 [0,2,0,0,0,0|2,0,0]=4 1624 B10R1.22 C1=C(C=C(C(=C1Br)Cl)Br)F PI-23707 [0,2,0,0,0,0|2,0,0]=4 1625 B10R1.22 C1=C(C=C(C(=C1Br)I)Br)F PI-20969 [0,2,0,0,0,0|2,0,0]=4 1626 B10R1.22 C1=C(C=C(C(=C1Br)N)Br)F PI-28411 [0,2,0,0,0,0|2,0,0]=4 1627 B10R1.22 C1=C(C=C(C(=C1Br)O)Br)F PI-28412 [0,2,0,0,0,0|2,0,0]=4 1628 B10R1.22 C1=C(C=C(C(=C1Br)O)Br)N PI-30764 [0,2,0,0,0,0|2,0,0]=4 1629 B10R1.22 C1=C(C=C(C(=C1Cl)Br)Cl)Cl PI-22627 [0,2,0,0,0,0|2,0,0]=4 1630 B10R1.22 C1=C(C=C(C(=C1Cl)Cl)Cl)N PI-14872 [0,2,0,0,0,0|2,0,0]=4 1631 B10R1.22 C1=C(C=C(C(=C1Cl)F)Cl)Br PI-41211 [0,2,0,0,0,0|2,0,0]=4 1632 B10R1.22 C1=C(C=C(C(=C1Cl)F)Cl)F PI-10479 [0,2,0,0,0,0|2,0,0]=4 1633 B10R1.22 C1=C(C=C(C(=C1Cl)N)Br)Br PI-17226 [0,2,0,0,0,0|2,0,0]=4 1634 B10R1.22 C1=C(C=C(C(=C1Cl)N)Br)Cl PI-14399 [0,2,0,0,0,0|2,0,0]=4 1635 B10R1.22 C1=C(C=C(C(=C1Cl)N)Br)F PI-20623 [0,2,0,0,0,0|2,0,0]=4 1636 B10R1.22 C1=C(C=C(C(=C1Cl)N)Cl)Br PI-33702 [0,2,0,0,0,0|2,0,0]=4 1637 B10R1.22 C1=C(C=C(C(=C1Cl)N)Cl)F PI-21032 [0,2,0,0,0,0|2,0,0]=4 1638 B10R1.22 C1=C(C=C(C(=C1Cl)N)Cl)N PI-30763 [0,2,0,0,0,0|2,0,0]=4 1639 B10R1.22 C1=C(C=C(C(=C1Cl)O)Cl)F PI-28479 [0,2,0,0,0,0|2,0,0]=4 1640 B10R1.22 C1=C(C=C(C(=C1F)Br)Br)Br PI-19388 [0,2,0,0,0,0|2,0,0]=4 1641 B10R1.22 C1=C(C=C(C(=C1F)Br)F)Br PI-45724 [0,2,0,0,0,0|2,0,0]=4 1642 B10R1.22 C1=C(C=C(C(=C1F)Br)F)Cl PI-42944 [0,2,0,0,0,0|2,0,0]=4 1643 B10R1.22 C1=C(C=C(C(=C1F)Br)F)N PI-21616 [0,2,0,0,0,0|2,0,0]=4 1644 B10R1.22 C1=C(C=C(C(=C1F)Br)F)O PI-34247 [0,2,0,0,0,0|1,0,0]=3 1645 B10R1.22 C1=C(C=C(C(=C1F)Cl)Br)Br PI-20020 [0,2,0,0,0,0|2,0,0]=4 1646 B10R1.22 C1=C(C=C(C(=C1F)Cl)Br)Cl PI-14401 [0,2,0,0,0,0|2,0,0]=4 1647 B10R1.22 C1=C(C=C(C(=C1F)Cl)F)Br PI-28213 [0,2,0,0,0,0|2,0,0]=4 1648 B10R1.22 C1=C(C=C(C(=C1F)Cl)F)F PI-28269 [0,2,0,0,0,0|2,0,0]=4 1649 B10R1.22 C1=C(C=C(C(=C1F)F)Br)F PI-32233 [0,2,0,0,0,0|2,0,0]=4 1650 B10R1.22 C1=C(C=C(C(=C1F)F)F)N PI-10460 [0,2,0,0,0,0|2,0,0]=4 1651 B10R1.22 C1=C(C=C(C(=C1F)F)F)O PI-31337 [0,2,0,0,0,0|1,0,0]=3 1652 B10R1.22 C1=C(C=C(C(=C1F)I)F)Br PI-34347 [0,2,0,0,0,0|2,0,0]=4 1653 B10R1.22 C1=C(C=C(C(=C1F)I)F)N PI-50567 [0,2,0,0,0,0|2,0,0]=4 1654 B10R1.22 C1=C(C=C(C(=C1F)N)Br)Br PI-16384 [0,2,0,0,0,0|2,0,0]=4 1655 B10R1.22 C1=C(C=C(C(=C1F)N)Br)Cl PI-14391 [0,2,0,0,0,0|2,0,0]=4 1656 B10R1.22 C1=C(C=C(C(=C1F)N)Br)F PI-11747 [0,2,0,0,0,0|2,0,0]=4 1657 B10R1.22 C1=C(C=C(C(=C1F)N)Br)F PI-21618 [0,2,0,0,0,0|2,0,0]=4 1658 B10R1.22 C1=C(C=C(C(=C1F)N)I)Cl PI-17576 [0,2,0,0,0,0|2,0,0]=4 1659 B10R1.22 C1=C(C=C(C(=C1F)O)Br)F PI-21643 [0,2,0,0,0,0|2,0,0]=4 1660 B10R1.22 C1=C(C=C(C(=C1F)O)F)F PI-28292 [0,2,0,0,0,0|2,0,0]=4 1661 B10R1.22 C1=C(C=C(C(=C1N)Cl)F)F PI-20028 [0,2,0,0,0,0|2,0,0]=4 1662 B10R1.22 C1=C(C=C(C(=C1N)F)F)F PI-10628 [0,2,0,0,0,0|2,0,0]=4 1663 B10R1.22 C1=C(C=C(C(=C1N)N)Br)Br PI-30909 [0,2,0,0,0,0|2,0,0]=4 1664 B10R1.22 C1=C(C=C(C(=C1N)N)F)F PI-17092 [0,2,0,0,0,0|2,0,0]=4 1665 B10R1.22 C1=C(C=C(C(=C1N)O)Cl)Cl PI-10562 [0,2,0,0,0,0|2,0,0]=4 1666 B10R1.22 C1=C(C=C(C(=C1O)F)F)Br PI-14414 [0,2,0,0,0,0|1,0,0]=3 1667 B10R1.22 CC1=C(Br)C(C)=CC(Cl)=C1 PI-46853 [0,2,0,0,0,0|1,0,0]=3 1668 B10R1.22 CC1=C(Br)C(C)=CC(I)=C1 PI-46854 [0,2,0,0,0,0|1,0,0]=3 1669 B10R1.22 CC1=C(C=C(C=C1Br)F)Br PI-49351 [0,2,0,0,0,0|2,0,0]=4 1670 B10R1.22 CC1=C(C=C(C=C1Br)N)Br PI-19100 [0,2,0,0,0,0|2,0,0]=4 1671 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Br PI-11245 [0,2,0,0,0,0|1,0,0]=3 1672 B10R1.22 CC1=CC(=C(C(=C1)Br)N)C PI-21676 [0,2,0,0,0,0|1,0,0]=3 1673 B10R1.22 CC1=CC(=C(C(=C1)C)Cl)C PI-19184 [0,2,0,0,0,0|1,0,0]=3 1674 B10R1.22 CC1=CC(=C(C(=C1)C)I)C PI-27568 [0,2,0,0,0,0|1,0,0]=3 1675 B10R1.22 CC1=CC(=C(C(=C1)C)S)C PI-17216 [0,2,0,0,0,0|1,0,0]=3 1676 B10R1.22 CC1=CC(=C(C(=C1)N)O)C PI-27576 [0,2,0,0,0,0|1,0,0]=3 1677 B10R1.22 CC1=CC(=C(C(=C1)O)C)C PI-11725 [0,2,0,0,0,0|0,0,0]=2 1678 B10R1.22 CC1=CC(=C(C(=C1)O)O)O PI-19757 [0,2,0,0,0,0|0,0,0]=2 1679 B10R1.22 CC1=CC(=C([N+](=C1)[O-])C)C PI-42566 [0,2,0,0,0,0|1,0,1]=4 1680 B10R1.22 CC1=CC(=CC(=C1C)C)N PI-36166 [0,2,0,0,0,0|1,0,0]=3 1681 B10R1.22 CC1=CC(=CC(=C1Cl)C)F PI-19148 [0,2,0,0,0,0|1,0,0]=3 1682 B10R1.22 CC1=CC(=CC(=C1I)C)O PI-21959 [0,2,0,0,0,0|0,0,0]=2 1683 B10R1.22 CC1=CC(=CC(=C1N)Br)Br PI-11778 [0,2,0,0,0,0|1,0,0]=3 1684 B10R1.22 CC1=CC(=CC(=C1N)Br)F PI-21460 [0,2,0,0,0,0|1,0,0]=3 1685 B10R1.22 CC1=CC(=CC(=C1N)C)Br PI-12728 [0,2,0,0,0,0|1,0,0]=3 1686 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PI-30373 [0,2,0,0,0,0|1,0,0]=3 1687 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PI-30732 [0,2,0,0,0,0|1,0,0]=3 1688 B10R1.22 CC1=CC(=CC(=C1N)C)I PI-32315 [0,2,0,0,0,0|1,0,0]=3 1689 B10R1.22 CC1=CC(=CC(=C1N)C)O PI-27461 [0,2,0,0,0,0|0,0,0]=2 1690 B10R1.22 CC1=CC(=CC(=C1N)Cl)Cl PI-30446 [0,2,0,0,0,0|1,0,0]=3 1691 B10R1.22 CC1=CC(=CC(=C1N)N)Br PI-19894 [0,2,0,0,0,0|1,0,0]=3 1692 B10R1.22 CC1=CC(=CC(=C1O)Br)F PI-42951 [0,2,0,0,0,0|1,0,0]=3 1693 B10R1.22 CC1=CC(=CC(=C1O)C)Cl PI-30067 [0,2,0,0,0,0|1,0,0]=3 1694 B10R1.22 CC1=CC(=CC(=C1O)C)I PI-21958 [0,2,0,0,0,0|1,0,0]=3 1695 B10R1.22 CC1=CC(=CC(=C1O)C)O PI-44190 [0,2,0,0,0,0|0,0,0]=2 1696 B10R1.22 CC1=CC(=O)NC(=C1C)O PI-12151 [0,2,0,0,0,0|1,0,0]=3 1697 B10R1.22 CC1=CC(=[N+](C(=C1)C)[O-])C PI-42563 [0,2,0,0,0,0|2,0,0]=4 1698 B10R1.22 CC1=CC(Br)=C(Cl)C(Br)=C1 PI-46838 [0,2,0,0,0,0|1,0,0]=3 1699 B10R1.22 CC1=CC(N)=CC(C)=C1I PI-24054 [0,2,0,0,0,0|1,0,0]=3 1700 B10R1.22 CC1=NC(=C(C(=O)N1)Br)O PI-45156 [0,2,0,0,0,0|2,0,0]=4 1701 B10R1.22 CC1=NC(=C(C(=O)N1)F)O PI-45144 [0,2,0,0,0,0|2,0,0]=4 1702 B10R1.22 Cc1cc(C)c(Br)c(C)c1 PI-36916 [0,2,0,0,0,0|1,0,0]=3 1703 B10R1.22 Cc1cc(C)c(N)c(C)c1 PI-34167 [0,2,0,0,0,0|1,0,0]=3 1704 B10R1.22 Cc1cc(C)c(c(c1)Br)O PI-38211 [0,2,0,0,0,0|1,0,0]=3 1705 B10R1.22 Cc1cc(O)c(C)c(O)c1 PI-19644 [0,2,0,0,0,0|0,0,0]=2 1706 B10R1.22 Clc1cc(C)c(c(c1)Cl)I PI-19228 [0,2,0,0,0,0|1,0,0]=3 1707 B10R1.22 Clc1cc(F)c(I)c(Br)c1 PI-20632 [0,2,0,0,0,0|2,0,0]=4 1708 B10R1.22 FC1=C(Br)C(Br)=CC(Cl)=C1 PI-20021 [0,2,0,0,0,0|2,0,0]=4 1709 B10R1.22 FC1=C(C(=CC(=C1)O)F)Cl PI-28005 [0,2,0,0,0,0|1,0,0]=3 1710 B10R1.22 FC1=C(F)C(Cl)=CC(Br)=C1 PI-41766 [0,2,0,0,0,0|2,0,0]=4 1711 B10R1.22 FC1=CC(F)=C(Br)C(F)=C1 PI-28301 [0,2,0,0,0,0|2,0,0]=4 1712 B10R1.22 Fc1cc(C)c(c(c1)F)F PI-19105 [0,2,0,0,0,0|1,0,0]=3 1713 B10R1.22 Fc1cc(F)c(F)c(F)c1 PI-28302 [0,2,0,0,0,0|2,0,0]=4 1714 B10R1.22 Fc1cc(F)c(c(c1)Br)I PI-14408 [0,2,0,0,0,0|2,0,0]=4 1715 B10R1.22 Fc1cc(F)c(c(c1)Cl)N PI-20029 [0,2,0,0,0,0|2,0,0]=4 1716 B10R1.22 Ic1cc(F)c(c(c1)F)Br PI-21633 [0,2,0,0,0,0|2,0,0]=4 1717 B10R1.22 NC1=C(F)C=C(F)C=C1F PI-16937 [0,2,0,0,0,0|2,0,0]=4 1718 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1N PI-46840 [0,2,0,0,0,0|2,0,0]=4 1719 B10R1.22 Nc1cc(Cl)c(O)c(Cl)c1 PI-11468 [0,2,0,0,0,0|2,0,0]=4 1720 B10R1.22 O=C1C(Br)=CC(Br)=CN1C PI-46656 [0,2,0,0,0,0|2,0,0]=4 1721 B10R1.22 O=C1C=C(C)C(=O)C(=C1)C PI-29659 [0,2,0,0,0,0|0,0,1]=3 1722 B10R1.22 OC1=C(Cl)C=C(Br)C=C1F PI-20634 [0,2,0,0,0,0|2,0,0]=4 1723 B10R1.22 Oc1cc(C)c(c(c1)C)Br PI-21392 [0,2,0,0,0,0|0,0,0]=2 1724 B10R1.119 C1=CC(=C(C(=C1Br)Cl)F)I PI-42950 [0,2,0,0,0,0|2,0,0]=4 1725 B10R1.119 C1=CC(=C(C(=C1Br)N)N)Br PI-40435 [0,2,0,0,0,0|2,0,0]=4 1726 B10R1.119 C1=CC(=C(C(=C1F)Cl)F)Cl PI-10477 [0,2,0,0,0,0|2,0,0]=4 1727 B10R1.119 C1=CC(=C(C(=C1F)F)Br)F PI-15586 [0,2,0,0,0,0|2,0,0]=4 1728 B10R1.119 C1=CC(=C(C(=C1F)F)F)Cl PI-11588 [0,2,0,0,0,0|2,0,0]=4 1729 B10R1.119 C1=CC(=C(C(=C1F)F)F)F PI-16923 [0,2,0,0,0,0|2,0,0]=4 1730 B10R1.119 C1=CC(=C(C(=C1F)N)F)F PI-10629 [0,2,0,0,0,0|2,0,0]=4 1731 B10R1.119 C1=CC(=C(C(=C1F)O)F)F PI-16880 [0,2,0,0,0,0|1,0,0]=3 1732 B10R1.119 C1=CC(=C(C(=C1N)F)Cl)O PI-46506 [0,2,0,0,0,0|1,0,0]=3 1733 B10R1.119 C1=CC(=C(C(=C1N)F)F)F PI-16952 [0,2,0,0,0,0|2,0,0]=4 1734 B10R1.119 C1=CC(=C(C(=C1N)F)F)O PI-46505 [0,2,0,0,0,0|1,0,0]=3 1735 B10R1.119 C1=CC(=C(C(=C1N)N)F)F PI-21206 [0,2,0,0,0,0|2,0,0]=4 1736 B10R1.119 C1=CC(=C(C(=C1O)Cl)N)Cl PI-11741 [0,2,0,0,0,0|1,0,0]=3 1737 B10R1.119 C1=CC(=C(C(=C1O)F)F)Br PI-34336 [0,2,0,0,0,0|1,0,0]=3 1738 B10R1.119 C1=CC(=C(C(=C1O)F)F)F PI-28343 [0,2,0,0,0,0|1,0,0]=3 1739 B10R1.119 C1=CC(=C(C(=C1O)F)F)I PI-34337 [0,2,0,0,0,0|1,0,0]=3 1740 B10R1.119 CC1=C(C(=C(C=C1)C)F)C PI-19379 [0,2,0,0,0,0|1,0,0]=3 1741 B10R1.119 CC1=C(C(=C(C=C1)Cl)Br)Cl PI-21604 [0,2,0,0,0,0|1,0,0]=3 1742 B10R1.119 CC1=C(C(=C(C=C1)Cl)C)N PI-30403 [0,2,0,0,0,0|1,0,0]=3 1743 B10R1.119 CC1=C(C(=C(C=C1)Cl)N)Cl PI-13570 [0,2,0,0,0,0|1,0,0]=3 1744 B10R1.119 CC1=C(C(=C(C=C1)N)Cl)O PI-16013 [0,2,0,0,0,0|1,0,0]=3 1745 B10R1.119 CC1=C(C(=C(C=C1)N)N)C PI-17413 [0,2,0,0,0,0|1,0,0]=3 1746 B10R1.119 CC1=C(C=CC(=C1C)F)N PI-19202 [0,2,0,0,0,0|1,0,0]=3 1747 B10R1.119 CC1=C(C=CC(=C1C)O)N PI-27460 [0,2,0,0,0,0|0,0,0]=2 1748 B10R1.119 CC1=C(C=CC(=C1Cl)Br)N PI-20643 [0,2,0,0,0,0|1,0,0]=3 1749 B10R1.119 CC1=C(C=CC(=C1Cl)Cl)Cl PI-34318 [0,2,0,0,0,0|1,0,0]=3 1750 B10R1.119 CC1=CC=C(Cl)C(Cl)=C1Cl PI-24595 [0,2,0,0,0,0|1,0,0]=3 1751 B10R1.119 CC1=NC=C(C(=C1Br)N)Br PI-13321 [0,2,0,0,0,0|2,0,0]=4 1752 B10R1.119 Cc1ccc(F)c(F)c1F PI-33076 [0,2,0,0,0,0|1,0,0]=3 1753 B10R1.119 Clc1cc[n+](c(c1C)C)[O-] PI-16714 [0,2,0,0,0,0|1,0,1]=4 1754 B10R1.119 Cn1ccc(=O)c(c1C)O PI-11673 [0,2,0,0,0,0|1,0,0]=3 1755 B10R1.119 Fc1c(O)ccc(c1F)O PI-33023 [0,2,0,0,0,0|1,0,0]=3 1756 B10R1.119 Fc1ccc(N)c(Br)c1F PI-34475 [0,2,0,0,0,0|2,0,0]=4 1757 B10R1.119 Fc1ccc(c(c1C)F)Br PI-19325 [0,2,0,0,0,0|1,0,0]=3 1758 B10R1.119 Fc1ccc(c(c1F)F)Br PI-16896 [0,2,0,0,0,0|2,0,0]=4 1759 B10R1.119 Nc1ccc(c(c1F)Br)F PI-39344 [0,2,0,0,0,0|2,0,0]=4 1760 B10R1.119 Oc1ccc(O)c(C)c1C PI-10300 [0,2,0,0,0,0|0,0,0]=2 1761 B10R1.245 BrCc1c(F)cccc1Cl PI-20077 [0,2,0,0,0,0|2,0,0]=4 1762 B10R1.245 BrCc1c(F)cccc1F PI-13392 [0,2,0,0,0,0|2,0,0]=4 1763 B10R1.245 C1=CC(=C(C(=C1)Br)C#N)F PI-10687 [0,2,0,0,0,0|2,0,0]=4 1764 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)Cl PI-35930 [0,2,0,0,0,0|2,0,0]=4 1765 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)N PI-40830 [0,2,0,0,0,0|2,0,0]=4 1766 B10R1.245 C1=CC(=C(C(=C1)Br)CBr)Cl PI-20621 [0,2,0,0,0,0|2,0,0]=4 1767 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)F PI-16136 [0,2,0,0,0,0|2,0,0]=4 1768 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)Cl PI-34227 [0,2,0,0,0,0|2,0,0]=4 1769 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)F PI-33406 [0,2,0,0,0,0|2,0,0]=4 1770 B10R1.245 C1=CC(=C(C(=C1)Cl)CO)Cl PI-32223 [0,2,0,0,0,0|2,0,0]=4 1771 B10R1.245 C1=CC(=C(C(=C1)Cl)CO)F PI-28646 [0,2,0,0,0,0|2,0,0]=4 1772 B10R1.245 C1=CC(=C(C(=C1)Cl)NN)Cl PI-29641 [0,2,0,0,0,0|2,0,0]=4 1773 B10R1.245 C1=CC(=C(C(=C1)F)C#N)F PI-31781 [0,2,0,0,0,0|2,0,0]=4 1774 B10R1.245 C1=CC(=C(C(=C1)F)C#N)N PI-28814 [0,2,0,0,0,0|2,0,0]=4 1775 B10R1.245 C1=CC(=C(C(=C1)F)C#N)O PI-10696 [0,2,0,0,0,0|1,0,0]=3 1776 B10R1.245 C1=CC(=C(C(=C1)F)CN)F PI-31271 [0,2,0,0,0,0|2,0,0]=4 1777 B10R1.245 C1=CC(=C(C(=C1)F)CN)N PI-15923 [0,2,0,0,0,0|2,0,0]=4 1778 B10R1.245 C1=CC(=C(C(=C1)F)CO)F PI-28243 [0,2,0,0,0,0|2,0,0]=4 1779 B10R1.245 C1=CC(=C(C(=C1)I)C#N)F PI-10698 [0,2,0,0,0,0|2,0,0]=4 1780 B10R1.245 C1=CC(=C(C(=C1)I)C=O)F PI-10580 [0,2,0,0,0,0|2,0,0]=4 1781 B10R1.245 CC1=C(C(=CC=C1)C)C#N PI-29833 [0,2,0,0,0,0|1,0,0]=3 1782 B10R1.245 CC1=C(C(=CC=C1)C)C=O PI-27082 [0,2,0,0,0,0|1,0,0]=3 1783 B10R1.245 CC1=C(C(=CC=C1)C)CO PI-19775 [0,2,0,0,0,0|1,0,0]=3 1784 B10R1.245 CC1=C(C(=CC=C1)C)NN PI-50511 [0,2,0,0,0,0|1,0,0]=3 1785 B10R1.245 CC1=C(C(=O)C=CN1)OC PI-40244 [0,2,0,0,0,0|1,0,1]=4 1786 B10R1.245 CC1=CC=CC(Cl)=C1C=O PI-27105 [0,2,0,0,0,0|1,0,0]=3 1787 B10R1.245 COC1=C(C=CC=C1Br)F PI-10731 [0,2,0,0,0,0|2,0,0]=4 1788 B10R1.245 COC1=C(C=CC=C1I)F PI-10732 [0,2,0,0,0,0|2,0,0]=4 1789 B10R1.245 COC1=C(C=CC=C1O)O PI-19401 [0,2,0,0,0,0|1,0,0]=3 1790 B10R1.245 COC1=C(Cl)C=CC=C1Cl PI-42640 [0,2,0,0,0,0|2,0,0]=4 1791 B10R1.245 COc1c(Br)cccc1Br PI-36881 [0,2,0,0,0,0|2,0,0]=4 1792 B10R1.245 COc1c(F)cccc1F PI-28529 [0,2,0,0,0,0|2,0,0]=4 1793 B10R1.245 COc1c(N)cccc1F PI-34516 [0,2,0,0,0,0|2,0,0]=4 1794 B10R1.245 COc1c(O)ccnc1C PI-38274 [0,2,0,0,0,0|1,0,0]=3 1795 B10R1.245 ClCc1c(C)cccc1C PI-23826 [0,2,0,0,0,0|1,0,0]=3 1796 B10R1.245 ClCc1c(F)cccc1F PI-21149 [0,2,0,0,0,0|2,0,0]=4 1797 B10R1.245 N#Cc1c(C)cccc1F PI-34464 [0,2,0,0,0,0|1,0,0]=3 1798 B10R1.245 N#Cc1c(C)cccc1N PI-30717 [0,2,0,0,0,0|1,0,0]=3 1799 B10R1.245 N#Cc1c(Cl)cccc1Cl PI-33090 [0,2,0,0,0,0|2,0,0]=4 1800 B10R1.245 NCc1c(C)cccc1C PI-39516 [0,2,0,0,0,0|1,0,0]=3 1801 B10R1.245 NCc1c(Cl)cccc1Cl PI-11763 [0,2,0,0,0,0|2,0,0]=4 1802 B10R1.245 NCc1c(F)cccc1Cl PI-20072 [0,2,0,0,0,0|2,0,0]=4 1803 B10R1.245 NNc1c(F)cccc1F PI-10482 [0,2,0,0,0,0|2,0,0]=4 1804 B10R1.245 NNc1c(F)cccc1F PI-10634 [0,2,0,0,0,0|2,0,0]=4 1805 B10R1.245 O=CC1=C(O)C=CC=C1Br PI-37162 [0,2,0,0,0,0|1,0,0]=3 1806 B10R1.245 O=Cc1c(Br)cccc1Br PI-35931 [0,2,0,0,0,0|2,0,0]=4 1807 B10R1.245 O=Cc1c(Cl)cccc1Cl PI-31780 [0,2,0,0,0,0|2,0,0]=4 1808 B10R1.245 O=Cc1c(F)cccc1Br PI-28929 [0,2,0,0,0,0|2,0,0]=4 1809 B10R1.245 O=Cc1c(F)cccc1Cl PI-16953 [0,2,0,0,0,0|2,0,0]=4 1810 B10R1.245 O=Cc1c(F)cccc1F PI-28528 [0,2,0,0,0,0|2,0,0]=4 1811 B10R1.245 O=Cc1c(O)cccc1Cl PI-27285 [0,2,0,0,0,0|1,0,0]=3 1812 B10R1.245 O=Cc1c(O)cccc1F PI-27539 [0,2,0,0,0,0|1,0,0]=3 1813 B10R1.245 O=Cc1c(O)cccc1O PI-39426 [0,2,0,0,0,0|1,0,0]=3 1814 B10R1.245 SCc1c(F)cccc1Cl PI-20085 [0,2,0,0,0,0|2,0,0]=4 1815 B10R1.25 BrCc1ccc(cc1F)F PI-28304 [0,2,0,0,0,0|2,0,0]=4 1816 B10R1.25 C(#N)C1=C(C=C(N)C=C1)F PI-38529 [0,2,0,0,0,0|2,0,0]=4 1817 B10R1.25 C1=CC(=C(C=C1Br)Cl)C#N PI-41206 [0,2,0,0,0,0|2,0,0]=4 1818 B10R1.25 C1=CC(=C(C=C1Br)Cl)C=O PI-38898 [0,2,0,0,0,0|2,0,0]=4 1819 B10R1.25 C1=CC(=C(C=C1Br)F)CBr PI-11844 [0,2,0,0,0,0|2,0,0]=4 1820 B10R1.25 C1=CC(=C(C=C1Br)F)CN PI-14436 [0,2,0,0,0,0|2,0,0]=4 1821 B10R1.25 C1=CC(=C(C=C1Br)F)CN PI-31021 [0,2,0,0,0,0|2,0,0]=4 1822 B10R1.25 C1=CC(=C(C=C1Br)F)CO PI-14434 [0,2,0,0,0,0|2,0,0]=4 1823 B10R1.25 C1=CC(=C(C=C1Br)O)C#N PI-43950 [0,2,0,0,0,0|1,0,0]=3 1824 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C#N PI-16132 [0,2,0,0,0,0|2,0,0]=4 1825 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CCl PI-33404 [0,2,0,0,0,0|2,0,0]=4 1826 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-11745 [0,2,0,0,0,0|2,0,0]=4 1827 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-34158 [0,2,0,0,0,0|2,0,0]=4 1828 B10R1.25 C1=CC(=C(C=C1Cl)F)C#N PI-10694 [0,2,0,0,0,0|2,0,0]=4 1829 B10R1.25 C1=CC(=C(C=C1Cl)F)C=O PI-28681 [0,2,0,0,0,0|2,0,0]=4 1830 B10R1.25 C1=CC(=C(C=C1Cl)F)CO PI-40484 [0,2,0,0,0,0|2,0,0]=4 1831 B10R1.25 C1=CC(=C(C=C1Cl)F)NN PI-50547 [0,2,0,0,0,0|2,0,0]=4 1832 B10R1.25 C1=CC(=C(C=C1F)Br)C#N PI-16379 [0,2,0,0,0,0|2,0,0]=4 1833 B10R1.25 C1=CC(=C(C=C1F)Br)C=O PI-10440 [0,2,0,0,0,0|2,0,0]=4 1834 B10R1.25 C1=CC(=C(C=C1F)Br)CBr PI-28684 [0,2,0,0,0,0|2,0,0]=4 1835 B10R1.25 C1=CC(=C(C=C1F)Cl)C#N PI-28676 [0,2,0,0,0,0|2,0,0]=4 1836 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O PI-28857 [0,2,0,0,0,0|2,0,0]=4 1837 B10R1.25 C1=CC(=C(C=C1F)Cl)CBr PI-20076 [0,2,0,0,0,0|2,0,0]=4 1838 B10R1.25 C1=CC(=C(C=C1F)Cl)CN PI-20071 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.25 C1=CC(=C(C=C1F)Cl)NN PI-50545 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.25 C1=CC(=C(C=C1F)F)NN PI-31217 [0,2,0,0,0,0|2,0,0]=4 1841 B10R1.25 C1=CC(=C(C=C1F)I)CBr PI-33648 [0,2,0,0,0,0|2,0,0]=4 1842 B10R1.25 C1=CC(=C(C=C1F)N)C=O PI-44252 [0,2,0,0,0,0|2,0,0]=4 1843 B10R1.25 C1=CC(=C(C=C1F)O)C=O PI-18485 [0,2,0,0,0,0|1,0,0]=3 1844 B10R1.25 C1=CC(=C(C=C1I)Br)C=O PI-26357 [0,2,0,0,0,0|2,0,0]=4 1845 B10R1.25 C1=CC(=C(C=C1I)F)C=O PI-28942 [0,2,0,0,0,0|2,0,0]=4 1846 B10R1.25 C1=CC(=C(C=C1N)N)C=O PI-44093 [0,2,0,0,0,0|2,0,0]=4 1847 B10R1.25 C1=CC(=C(C=C1O)O)CO PI-11751 [0,2,0,0,0,0|1,0,0]=3 1848 B10R1.25 CC1=C(C=CC(=C1)Br)C#N PI-22131 [0,2,0,0,0,0|1,0,0]=3 1849 B10R1.25 CC1=C(C=CC(=C1)Br)OC PI-21586 [0,2,0,0,0,0|1,0,0]=3 1850 B10R1.25 CC1=C(C=CC(=C1)Cl)NN PI-29295 [0,2,0,0,0,0|1,0,0]=3 1851 B10R1.25 CC1=C(C=CC(=C1)Cl)OC PI-19447 [0,2,0,0,0,0|1,0,0]=3 1852 B10R1.25 CC1=C(C=CC(=C1)F)C#N PI-10521 [0,2,0,0,0,0|1,0,0]=3 1853 B10R1.25 CC1=C(C=CC(=C1)F)C=O PI-10459 [0,2,0,0,0,0|1,0,0]=3 1854 B10R1.25 CC1=C(C=CC(=N1)Cl)C#N PI-44536 [0,2,0,0,0,0|2,0,0]=4 1855 B10R1.25 CC1=CC(=C(C=C1)C#N)C PI-23422 [0,2,0,0,0,0|1,0,0]=3 1856 B10R1.25 CC1=CC(=C(C=C1)C#N)N PI-30405 [0,2,0,0,0,0|1,0,0]=3 1857 B10R1.25 CC1=CC(=C(C=C1)C=O)Br PI-26931 [0,2,0,0,0,0|1,0,0]=3 1858 B10R1.25 CC1=CC(=C(C=C1)C=O)F PI-31460 [0,2,0,0,0,0|1,0,0]=3 1859 B10R1.25 CC1=CC(=C(C=C1)CCl)C PI-23825 [0,2,0,0,0,0|1,0,0]=3 1860 B10R1.25 CC1=CC(=C(C=C1)CO)N PI-26925 [0,2,0,0,0,0|1,0,0]=3 1861 B10R1.25 CC1=CC(=C(C=C1)NN)C PI-29747 [0,2,0,0,0,0|1,0,0]=3 1862 B10R1.25 CC1=CC(=C(C=C1)NN)Cl PI-20171 [0,2,0,0,0,0|1,0,0]=3 1863 B10R1.25 CC1=CC(=C(C=C1)OC)Cl PI-19323 [0,2,0,0,0,0|1,0,0]=3 1864 B10R1.25 CC1=CC(=C(C=C1)OC)F PI-23730 [0,2,0,0,0,0|1,0,0]=3 1865 B10R1.25 CC1=CC(=C(C=C1)OC)I PI-19656 [0,2,0,0,0,0|1,0,0]=3 1866 B10R1.25 CC1=CC(=C(C=C1)[N+]#[C-])Br PI-22160 [0,2,0,0,0,0|1,0,0]=3 1867 B10R1.25 CC1=CC(=CN=C1C=O)Br PI-41887 [0,2,0,0,0,0|2,0,0]=4 1868 B10R1.25 CC1=CC(=NC=C1C#N)Br PI-44897 [0,2,0,0,0,0|2,0,0]=4 1869 B10R1.25 CC1=CC(=NC=C1C#N)Br PI-44922 [0,2,0,0,0,0|2,0,0]=4 1870 B10R1.25 CC1=CC(Br)=CN=C1OC PI-46636 [0,2,0,0,0,0|2,0,0]=4 1871 B10R1.25 CC1=CC(I)=CC=C1OC PI-19887 [0,2,0,0,0,0|1,0,0]=3 1872 B10R1.25 CC1=CC=C(OC)C(Br)=C1 PI-16425 [0,2,0,0,0,0|1,0,0]=3 1873 B10R1.25 CCC1=C(C=C(C=C1)O)O PI-27436 [0,2,0,0,0,0|1,0,0]=3 1874 B10R1.25 CCC1=C(N=C(C=C1)C)N PI-30602 [0,2,0,0,0,0|2,0,0]=4 1875 B10R1.25 CNC1=CC=C(F)C=C1F PI-21200 [0,2,0,0,0,0|2,0,0]=4 1876 B10R1.25 COC1=C(C=C(C=C1)Cl)F PI-33133 [0,2,0,0,0,0|2,0,0]=4 1877 B10R1.25 COC1=C(C=C(C=C1)F)Cl PI-20055 [0,2,0,0,0,0|2,0,0]=4 1878 B10R1.25 COC1=C(C=C(C=C1)F)F PI-16982 [0,2,0,0,0,0|2,0,0]=4 1879 B10R1.25 COC1=C(C=C(C=C1)F)F PI-34388 [0,2,0,0,0,0|2,0,0]=4 1880 B10R1.25 COC1=C(C=C(C=C1)F)N PI-34515 [0,2,0,0,0,0|2,0,0]=4 1881 B10R1.25 COC1=C(C=C(C=C1)F)O PI-34264 [0,2,0,0,0,0|1,0,0]=3 1882 B10R1.25 COC1=C(C=C(C=C1)N)N PI-17225 [0,2,0,0,0,0|2,0,0]=4 1883 B10R1.25 COC1=C(O)C=C(N)C=C1 PI-27246 [0,2,0,0,0,0|1,0,0]=3 1884 B10R1.25 COc1ccc(F)cc1S PI-23728 [0,2,0,0,0,0|1,1,0]=4 1885 B10R1.25 COc1ccc(S)cc1F PI-23727 [0,2,0,0,0,0|1,1,0]=4 1886 B10R1.25 COc1ccc(cc1Br)Cl PI-20603 [0,2,0,0,0,0|2,0,0]=4 1887 B10R1.25 COc1ccc(cc1Br)F PI-28540 [0,2,0,0,0,0|2,0,0]=4 1888 B10R1.25 COc1ccc(cc1Cl)N PI-38593 [0,2,0,0,0,0|2,0,0]=4 1889 B10R1.25 COc1ccc(cc1F)Br PI-16907 [0,2,0,0,0,0|2,0,0]=4 1890 B10R1.25 COc1ccc(cc1F)N PI-28446 [0,2,0,0,0,0|2,0,0]=4 1891 B10R1.25 COc1ccc(cc1F)O PI-34292 [0,2,0,0,0,0|1,0,0]=3 1892 B10R1.25 CSc1ccc(cc1C)O PI-18452 [0,2,0,0,0,0|0,0,0]=2 1893 B10R1.25 Cc1ccc(c(n1)Cl)C#N PI-17315 [0,2,0,0,0,0|2,0,0]=4 1894 B10R1.25 Cc1ccc(c(n1)Cl)CO PI-36936 [0,2,0,0,0,0|2,0,0]=4 1895 B10R1.25 ClC1=CC(=C(C=O)C=C1)O PI-26343 [0,2,0,0,0,0|1,0,0]=3 1896 B10R1.25 ClCc1ccc(cc1Cl)F PI-20080 [0,2,0,0,0,0|2,0,0]=4 1897 B10R1.25 FC1=C(C=O)C=CC(=C1)O PI-28419 [0,2,0,0,0,0|1,0,0]=3 1898 B10R1.25 N#CC1=CC=C(O)C=C1F PI-16085 [0,2,0,0,0,0|1,0,0]=3 1899 B10R1.25 N#Cc1ccc(Cl)cc1N PI-11782 [0,2,0,0,0,0|2,0,0]=4 1900 B10R1.25 N#Cc1ccc(O)cc1O PI-11750 [0,2,0,0,0,0|1,0,0]=3 1901 B10R1.25 N#Cc1ccc(cc1Cl)N PI-30296 [0,2,0,0,0,0|2,0,0]=4 1902 B10R1.25 N#Cc1ccc(cc1F)Br PI-16087 [0,2,0,0,0,0|2,0,0]=4 1903 B10R1.25 N#Cc1ccc(cc1F)C PI-28867 [0,2,0,0,0,0|1,0,0]=3 1904 B10R1.25 N#Cc1ncc(O)cc1C PI-36497 [0,2,0,0,0,0|1,0,0]=3 1905 B10R1.25 NC1=C(C=O)C=CC(=C1)Br PI-41093 [0,2,0,0,0,0|2,0,0]=4 1906 B10R1.25 NCc1ccc(cc1C)C PI-27988 [0,2,0,0,0,0|1,0,0]=3 1907 B10R1.25 NCc1ccc(cc1F)F PI-28783 [0,2,0,0,0,0|2,0,0]=4 1908 B10R1.25 NNc1ccc(cc1F)F PI-31187 [0,2,0,0,0,0|2,0,0]=4 1909 B10R1.25 O=CC1=CC=C(F)C=C1F PI-16892 [0,2,0,0,0,0|2,0,0]=4 1910 B10R1.25 O=Cc1ccc(Br)cc1F PI-31236 [0,2,0,0,0,0|2,0,0]=4 1911 B10R1.25 O=Cc1ccc(C)cc1O PI-20805 [0,2,0,0,0,0|0,0,0]=2 1912 B10R1.25 O=Cc1ccc(O)cc1Cl PI-10303 [0,2,0,0,0,0|1,0,0]=3 1913 B10R1.25 O=Cc1ccc(O)cc1O PI-11749 [0,2,0,0,0,0|1,0,0]=3 1914 B10R1.25 O=Cc1ccc(cc1Br)Cl PI-36966 [0,2,0,0,0,0|2,0,0]=4 1915 B10R1.25 O=Cc1ccc(cc1C)C PI-27218 [0,2,0,0,0,0|1,0,0]=3 1916 B10R1.25 O=Cc1ccc(cc1C)Cl PI-27562 [0,2,0,0,0,0|1,0,0]=3 1917 B10R1.25 O=Cc1ccc(cc1O)Br PI-26320 [0,2,0,0,0,0|1,0,0]=3 1918 B10R1.25 OC1=CC(=C(C=O)C=C1)C PI-18542 [0,2,0,0,0,0|0,0,0]=2 1919 B10R1.25 OCc1ccc(Cl)cc1Cl PI-12129 [0,2,0,0,0,0|2,0,0]=4 1920 B10R1.25 OCc1ccc(F)cc1F PI-28645 [0,2,0,0,0,0|2,0,0]=4 1921 B10R1.25 OCc1ccc(cc1Br)F PI-39278 [0,2,0,0,0,0|2,0,0]=4 1922 B10R1.25 OCc1ccc(cc1C)C PI-38556 [0,2,0,0,0,0|1,0,0]=3 1923 B10R1.25 SCc1ccc(Br)cc1F PI-21443 [0,2,0,0,0,0|2,0,0]=4 1924 B10R1.25 [C-]#[N+]c1ccc(Br)cc1F PI-21480 [0,2,0,0,0,0|2,0,0]=4 1925 B10R1.25 [C-]#[N+]c1ccc(F)cc1C PI-23767 [0,2,0,0,0,0|1,0,0]=3 1926 B10R1.118 BrC1=CC(I)=C(Br)C=C1I PI-39701 [0,2,0,0,0,0|2,0,0]=4 1927 B10R1.118 Brc1cc(Br)c(Br)cc1C PI-30476 [0,2,0,0,0,0|1,0,0]=3 1928 B10R1.118 Brc1cc(F)c(F)cc1C PI-19963 [0,2,0,0,0,0|1,0,0]=3 1929 B10R1.118 Brc1cc(F)c(F)cc1O PI-28194 [0,2,0,0,0,0|1,0,0]=3 1930 B10R1.118 C1=C(C(=CC(=C1Br)Br)F)F PI-28721 [0,2,0,0,0,0|2,0,0]=4 1931 B10R1.118 C1=C(C(=CC(=C1Br)F)F)N PI-21617 [0,2,0,0,0,0|2,0,0]=4 1932 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)Cl)S PI-17209 [0,2,0,0,0,0|1,1,0]=4 1933 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)N)N PI-20947 [0,2,0,0,0,0|2,0,0]=4 1934 B10R1.118 C1=C(C(=CC(=C1Cl)N)Cl)N PI-31454 [0,2,0,0,0,0|2,0,0]=4 1935 B10R1.118 C1=C(C(=CC(=C1F)Br)F)N PI-14403 [0,2,0,0,0,0|2,0,0]=4 1936 B10R1.118 C1=C(C(=CC(=C1F)Br)F)O PI-21644 [0,2,0,0,0,0|1,0,0]=3 1937 B10R1.118 C1=C(C(=CC(=C1F)Cl)Cl)N PI-28421 [0,2,0,0,0,0|2,0,0]=4 1938 B10R1.118 C1=C(C(=CC(=C1F)Cl)N)N PI-20018 [0,2,0,0,0,0|2,0,0]=4 1939 B10R1.118 C1=C(C(=CC(=C1F)F)F)F PI-16924 [0,2,0,0,0,0|2,0,0]=4 1940 B10R1.118 C1=C(C(=CC(=C1F)F)F)N PI-16943 [0,2,0,0,0,0|2,0,0]=4 1941 B10R1.118 C1=C(C(=CC(=C1F)F)F)O PI-34333 [0,2,0,0,0,0|1,0,0]=3 1942 B10R1.118 C1=C(C(=CC(=C1F)F)N)N PI-40950 [0,2,0,0,0,0|2,0,0]=4 1943 B10R1.118 C1=C(C(=CC(=C1F)O)F)N PI-14079 [0,2,0,0,0,0|1,0,0]=3 1944 B10R1.118 C1=C(C(=CC(=C1N)O)O)N PI-10078 [0,2,0,0,0,0|1,0,0]=3 1945 B10R1.118 C1=C(C(=CC(=C1N)O)O)N PI-19166 [0,2,0,0,0,0|1,0,0]=3 1946 B10R1.118 C1=C(C(=CC(=C1O)Cl)Cl)N PI-13030 [0,2,0,0,0,0|1,0,0]=3 1947 B10R1.118 CC1=CC(=C(C=C1Br)C)Br PI-33682 [0,2,0,0,0,0|1,0,0]=3 1948 B10R1.118 CC1=CC(=C(C=C1Br)N)F PI-43271 [0,2,0,0,0,0|1,0,0]=3 1949 B10R1.118 CC1=CC(=C(C=C1C)N)N PI-30467 [0,2,0,0,0,0|1,0,0]=3 1950 B10R1.118 CC1=CC(=C(C=C1C)S)C PI-17211 [0,2,0,0,0,0|0,1,0]=3 1951 B10R1.118 CC1=CC(=C(C=C1Cl)C)S PI-17574 [0,2,0,0,0,0|0,1,0]=3 1952 B10R1.118 CC1=CC(=C(C=C1Cl)Cl)Cl PI-19822 [0,2,0,0,0,0|1,0,0]=3 1953 B10R1.118 CC1=CC(=C(C=C1Cl)N)N PI-19789 [0,2,0,0,0,0|1,0,0]=3 1954 B10R1.118 CC1=CC(=C(C=C1F)Cl)Br PI-20637 [0,2,0,0,0,0|1,0,0]=3 1955 B10R1.118 CC1=CC(=C(C=C1F)N)Br PI-21461 [0,2,0,0,0,0|1,0,0]=3 1956 B10R1.118 CC1=CC(=C(C=C1I)C)O PI-21957 [0,2,0,0,0,0|0,0,0]=2 1957 B10R1.118 CC1=CC(=C(C=C1O)C)N PI-27462 [0,2,0,0,0,0|0,0,0]=2 1958 B10R1.118 CC1=CC(=C(N=C1Br)Br)Br PI-28485 [0,2,0,0,0,0|2,0,0]=4 1959 B10R1.118 CC1=CC(=O)C(=CC1=O)Cl PI-19280 [0,2,0,0,0,0|0,0,1]=3 1960 B10R1.118 CC1=NC(=C(C=C1Br)Br)N PI-13316 [0,2,0,0,0,0|2,0,0]=4 1961 B10R1.118 Cc1cc(Br)c(cc1C)Br PI-19362 [0,2,0,0,0,0|1,0,0]=3 1962 B10R1.118 Cc1cc(I)c(cc1I)C PI-19056 [0,2,0,0,0,0|1,0,0]=3 1963 B10R1.118 ClC1=CC(=O)C(=CC1=O)Cl PI-31951 [0,2,0,0,0,0|1,0,1]=4 1964 B10R1.118 Clc1cc(Cl)c(cc1O)Cl PI-34305 [0,2,0,0,0,0|1,0,0]=3 1965 B10R1.118 Clc1cc(F)c(cc1O)Br PI-31708 [0,2,0,0,0,0|1,0,0]=3 1966 B10R1.118 Fc1cc(Br)c(Cl)cc1Cl PI-32540 [0,2,0,0,0,0|2,0,0]=4 1967 B10R1.118 Fc1cc(Br)c(cc1Br)F PI-28381 [0,2,0,0,0,0|2,0,0]=4 1968 B10R1.118 Fc1cc(Br)c(cc1C)Cl PI-20636 [0,2,0,0,0,0|1,0,0]=3 1969 B10R1.118 Fc1cc(Br)c(cc1F)F PI-31151 [0,2,0,0,0,0|2,0,0]=4 1970 B10R1.118 Fc1cc(Cl)c(cc1C)N PI-28095 [0,2,0,0,0,0|1,0,0]=3 1971 B10R1.118 Fc1cc(I)c(cc1Br)F PI-21632 [0,2,0,0,0,0|2,0,0]=4 1972 B10R1.118 Nc1cc(Br)c(Br)cc1N PI-36095 [0,2,0,0,0,0|2,0,0]=4 1973 B10R1.118 Nc1cc(F)c(Br)cc1C PI-21463 [0,2,0,0,0,0|1,0,0]=3 1974 B10R1.118 Nc1cc(S)c(N)cc1S PI-17237 [0,2,0,0,0,0|1,1,0]=4 1975 B10R1.118 Oc1cc(Br)c(O)cc1Br PI-36804 [0,2,0,0,0,0|1,0,0]=3 1976 B10R1.118 Oc1cc(Cl)c(cc1Cl)O PI-33342 [0,2,0,0,0,0|1,0,0]=3 1977 B8R1.7 C1=COC(=C1)C(=O)N PI-17349 [0,0,1,1,0,0|2,0,0]=4 1978 B8R1.7 CC(=O)C1=CC=CN1 PI-12083 [0,0,1,1,0,0|2,0,0]=4 1979 B8R1.7 NC(=S)c1ccco1 PI-19230 [0,0,1,1,0,0|2,0,0]=4 1980 B8R1.7 OC(=O)c1ccc[nH]1 PI-27813 [0,0,1,1,0,0|2,0,0]=4 1981 B8R1.7 OC(=O)c1cccs1 PI-38239 [0,0,1,1,0,0|2,0,0]=4 1982 B8R1.8 CSCC1=CC=CO1 PI-48491 [0,0,1,1,0,0|1,0,1]=4 1983 B8R2.34 C12C=CC(C1)C=C2 PI-39675 [1,0,0,1,0,0|0,0,2]=4 1984 B10R2.31 BrC1=CC2=C(CC2)C=C1 PI-37003 [0,1,0,1,0,0|1,0,0]=3 1985 B10R2.31 NC1=CC=C2CCC2=C1 PI-40931 [0,1,0,1,0,0|1,0,0]=3 1986 B10R2.31 OC1=CC=C2CCC2=C1 PI-42598 [0,1,0,1,0,0|0,0,0]=2 1987 B6R0.3 CC=C(C)C(=O)O PI-40492 [0,0,1,0,1,0|1,0,1]=4 1988 B6R1.2 Brc1ccco1 PI-14449 [1,0,0,0,1,0|2,0,0]=4 1989 B6R1.2 Brc1cccs1 PI-11144 [1,0,0,0,1,0|2,0,0]=4 1990 B6R1.2 Brc1cscc1 PI-10760 [1,0,0,0,1,0|2,0,0]=4 1991 B6R1.2 C1=CNC=C1F PI-49258 [1,0,0,0,1,0|2,0,0]=4 1992 B6R1.2 C1=CSC=C1F PI-49323 [1,0,0,0,1,0|2,0,0]=4 1993 B6R1.2 CC1=CC=CS1 PI-11146 [1,0,0,0,1,0|1,0,0]=3 1994 B6R1.2 CC1=CN=CN1 PI-44758 [1,0,0,0,1,0|2,0,0]=4 1995 B6R1.2 CC1=COC=C1 PI-41011 [1,0,0,0,1,0|1,0,0]=3 1996 B6R1.2 Cc1c[nH]nc1 PI-34810 [1,0,0,0,1,0|2,0,0]=4 1997 B6R1.2 Cc1cc[nH]n1 PI-31344 [1,0,0,0,1,0|2,0,0]=4 1998 B6R1.2 Cc1cncs1 PI-33497 [1,0,0,0,1,0|2,0,0]=4 1999 B6R1.2 Cc1nccs1 PI-11132 [1,0,0,0,1,0|2,0,0]=4 2000 B6R1.2 ClC1=CSC=C1 PI-11160 [1,0,0,0,1,0|2,0,0]=4 2001 B6R1.2 Cn1cccn1 PI-37584 [1,0,0,0,1,0|2,0,0]=4 2002 B6R1.2 Cn1cncc1 PI-31809 [1,0,0,0,1,0|2,0,0]=4 2003 B6R1.2 Ic1cccs1 PI-11145 [1,0,0,0,1,0|2,0,0]=4 2004 B6R1.2 Sc1cccs1 PI-27908 [1,0,0,0,1,0|1,1,0]=4