0 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SPC-g746 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SPC-g513 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.113 CC1=CC(C(=O)O)=CN=N1 SPC-v546 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.113 CC1=CC(C(=O)O)=NC=N1 SPC-m029 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.113 CC1=CC(C(=O)O)=NN=C1 SPC-m730 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 CC1=CC=NC(C(=O)O)=N1 SPC-k969 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.113 NC(=O)C1=CC=NC(Cl)=N1 SPC-p214 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 SPC-m628 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SPC-g504 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SPC-g233 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.113 NC1=NC=CC(C(=O)O)=C1 SPC-g225 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SPC-s846 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 SPC-g633 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 SPC-h274 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 SPC-m109 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.113 O=C(O)C1=CC(F)=CN=C1 SPC-g694 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SPC-g630 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 SPC-t071 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 SPC-g340 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 SPC-m984 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 SPC-g574 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SPC-g433 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SPC-k816 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 SPC-t005 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.113 O=C(O)C1=NC=CC(I)=C1 SPC-m662 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 SPC-g190 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 SPC-n990 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.113 OC1=CC(C(F)F)=NC=C1 SPC-d167 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.2 C=CC1=CC(F)=CN=C1 SPC-p370 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.2 C=CC1=CC=CC(Br)=N1 SPC-r225 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.2 CC1=CC(CO)=CN=C1 SPC-j744 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.2 CC1=CC=NC(C=O)=N1 SPC-t698 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.2 NC1=NC=CC(CO)=C1 SPC-j636 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.2 O=C1C=C(CO)C=CN1 SPC-j416 [1,0,0,0,0,0|1,0,2]=4 34 B9R1.2 O=CC1=CC(Cl)=CN=C1 SPC-t054 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.2 O=CC1=CC(Cl)=NC=C1 SPC-g523 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.2 O=CC1=CC(F)=CN=C1 SPC-m553 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.2 O=CC1=CC=CC(Br)=N1 SPC-j152 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.2 O=CC1=NC=CC(Br)=C1 SPC-p520 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.2 O=CC1=NC=CC(Cl)=C1 SPC-g681 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.2 OCC1=CC(Br)=CN=C1 SPC-g623 [1,0,0,0,0,0|2,0,1]=4 41 B9R1.2 OCC1=CC(F)=CN=C1 SPC-h492 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.2 OCC1=NC=CC(Br)=C1 SPC-h210 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.6 CC(=O)C1=CN=CN=C1 SPC-j094 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.6 CC(=O)C1=CN=NC=C1 SPC-r163 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.6 CC(=O)C1=NC=CC=N1 SPC-k981 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.6 CC(=O)C1=NN=CC=C1 SPC-j101 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.6 C[C@H](O)C1=CC=CC=C1 SPC-s644 [1,0,0,0,0,0|1,0,1]=3 48 B9R1.6 O=C(O)C1=CN=CN=C1 SPC-g357 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.6 O=C(O)C1=CN=NC=C1 SPC-n492 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.6 O=C(O)C1=NC=CC=N1 SPC-g298 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.6 O=C(O)C1=NC=CN=C1 SPC-g023 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.6 O=C(O)C1=NC=NC=C1 SPC-g351 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.6 O=C(O)C1=NN=CC=C1 SPC-g662 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.6 OB(O)C1=CC=NC=C1 SPC-g497 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.6 OB(O)C1=CN=CC=C1 SPC-g050 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.21 CC1=NC=C(C(=O)O)C=C1N SPC-m181 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.21 CN1C=C(C(=O)O)C=CC1=O SPC-j150 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.21 CN1C=CC(C(=O)O)=CC1=O SPC-g869 [0,1,0,0,0,0|1,0,1]=3 59 B11R1.21 CN1C=CC(C(N)=O)=CC1=O SPC-t892 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 SPC-n109 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br SPC-j257 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 SPC-t585 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 SPC-t067 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 SPC-m316 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 SPC-u326 [0,1,0,0,0,0|1,0,1]=3 66 B11R1.23 COC(=O)C1=CC(=O)NC=C1 SPC-g578 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 SPC-g200 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 SPC-h440 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.23 COC(=O)C1=CC(F)=CN=C1 SPC-n446 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.23 COC(=O)C1=CC=NC(Cl)=N1 SPC-k177 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.23 COC(=O)C1=CN=CC(Cl)=N1 SPC-m476 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.23 COC(=O)C1=NC(C)=CC=N1 SPC-k581 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.23 COC(=O)C1=NC(N)=CC=C1 SPC-g321 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 SPC-g575 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SPC-g180 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.23 COC(=O)C1=NC=CC(F)=C1 SPC-r207 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.23 COC(=O)C1=NC=CC(N)=C1 SPC-j118 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.23 COC(=O)C1=NC=NC(C)=C1 SPC-t667 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.23 COC(=O)C1=NC=NC(N)=C1 SPC-n449 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.23 COC(=O)C1=NN=CC(C)=C1 SPC-q154 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 SPC-j352 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 SPC-t754 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 SPC-s862 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 SPC-m595 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 SPC-m327 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=N1 SPC-t774 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=N1 SPC-s532 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.159 CC1=C(Br)C=CC=C1[N+](=O)[O-] SPC-k277 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O SPC-u228 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N SPC-t765 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.159 CN1C=CC=C(C(=O)O)C1=O SPC-p035 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 SPC-n011 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O SPC-p488 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1F SPC-k441 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1F SPC-m363 [0,1,0,0,0,0|1,0,1]=3 96 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl SPC-n684 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F SPC-j994 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 SPC-k299 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 SPC-n249 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 SPC-t888 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.167 CC1=C(C(=O)O)N=C(Cl)N=C1 SPC-v261 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 SPC-u756 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 SPC-g542 [0,1,0,0,0,0|1,0,0]=2 104 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 SPC-j717 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 SPC-p323 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 SPC-n052 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 SPC-v649 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 SPC-p680 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=C1 SPC-j426 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 SPC-j633 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O SPC-g923 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.167 NC1=CN=C(F)C=C1C(=O)O SPC-t026 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O SPC-j139 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.167 NC1=NC=C(F)C=C1C(=O)O SPC-p162 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=N1 SPC-g698 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=N1 SPC-v203 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 SPC-g237 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl SPC-p650 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.167 O=C(O)C1=CC(Br)=CN=C1F SPC-t586 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O SPC-h714 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl SPC-m616 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F SPC-s841 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1Cl SPC-g528 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl SPC-g236 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br SPC-r106 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br SPC-r109 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(Cl)=C1 SPC-s766 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.266 C#CC1=CC=CC(B(O)O)=C1 SPC-k166 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.266 COC1=CC(C(=O)O)=CN=N1 SPC-p817 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.266 O=[N+]([O-])C1=CC(CO)=NC=C1 SPC-k741 [0,1,0,0,0,0|2,0,1]=4 131 B9R1.35 CC(=O)C1=CSC(Cl)=C1 SPC-h825 [0,0,0,0,1,0|3,0,0]=4 132 B9R1.35 CC1=CSC(C(=O)O)=C1 SPC-n156 [0,0,0,0,1,0|2,0,0]=3 133 B9R1.35 CC1=NNC(C(=O)O)=C1 SPC-k758 [0,0,0,0,1,0|3,0,0]=4 134 B9R1.35 CN1C=C(C(=O)O)C=N1 SPC-g547 [0,0,0,0,1,0|3,0,0]=4 135 B9R1.35 CN1C=CC(C(=O)O)=N1 SPC-t579 [0,0,0,0,1,0|3,0,0]=4 136 B9R1.35 CN1C=NC(C(=O)O)=C1 SPC-j762 [0,0,0,0,1,0|3,0,0]=4 137 B9R1.35 NC(=O)C1=CC=C(Br)N1 SPC-m101 [0,0,0,0,1,0|3,0,0]=4 138 B9R1.35 NC1=NC(C(=O)O)=CO1 SPC-k774 [0,0,0,0,1,0|3,0,0]=4 139 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SPC-g094 [0,0,0,0,1,0|2,0,0]=3 140 B9R1.35 O=C(O)C1=CC=C(F)S1 SPC-j710 [0,0,0,0,1,0|2,0,0]=3 141 B9R1.35 O=C(O)C1=CN=C(Br)S1 SPC-p181 [0,0,0,0,1,0|3,0,0]=4 142 B9R1.35 O=C(O)C1=CSC(Br)=C1 SPC-t048 [0,0,0,0,1,0|2,0,0]=3 143 B9R1.35 O=C(O)C1=CSC(Cl)=C1 SPC-j712 [0,0,0,0,1,0|2,0,0]=3 144 B9R1.35 O=C(O)C1=NC(Br)=CS1 SPC-k776 [0,0,0,0,1,0|3,0,0]=4 145 B9R1.35 O=C(O)C1=NC=C(Br)S1 SPC-n181 [0,0,0,0,1,0|3,0,0]=4 146 B9R1.41 CC1=CSC=C1C(=O)O SPC-r375 [0,0,0,0,1,0|2,0,0]=3 147 B9R1.41 CN1C=NC=C1C(=O)O SPC-g435 [0,0,0,0,1,0|3,0,0]=4 148 B9R1.41 CN1N=CC=C1C(=O)O SPC-g327 [0,0,0,0,1,0|3,0,0]=4 149 B9R1.41 NC(=O)C1=CC=CN1N SPC-r256 [0,0,0,0,1,0|3,0,0]=4 150 B9R1.41 NC1=C(C(=O)O)C=CS1 SPC-t631 [0,0,0,0,1,0|2,0,0]=3 151 B9R1.41 O=C(O)C1=C(Br)C=CS1 SPC-g312 [0,0,0,0,1,0|2,0,0]=3 152 B9R1.41 O=C(O)C1=CSC=C1Br SPC-m027 [0,0,0,0,1,0|2,0,0]=3 153 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 SPC-r232 [0,0,0,0,0,1|2,0,0]=3 154 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 SPC-m551 [0,0,0,0,0,1|2,0,0]=3 155 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 SPC-m615 [0,0,0,0,0,1|2,0,0]=3 156 B8R1.2 O=CC1=CN=CC=C1 SPC-g255 [2,0,0,0,0,0|1,0,0]=3 157 B8R1.2 O=CC1=CN=CN=C1 SPC-j129 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.2 O=CC1=CN=NC=C1 SPC-n491 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.2 O=CC1=NC=CC=N1 SPC-j098 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.2 O=CC1=NC=CN=C1 SPC-j095 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 OCC1=CN=CC=C1 SPC-g084 [2,0,0,0,0,0|1,0,1]=4 162 B8R1.4 CC1=CC(O)=CN=C1 SPC-t060 [2,0,0,0,0,0|1,0,1]=4 163 B8R1.4 CC1=NC=CC(O)=C1 SPC-r417 [2,0,0,0,0,0|1,0,1]=4 164 B8R1.4 NC1=CC(=O)NC=C1 SPC-g876 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.4 O=C1C=C(Br)C=CN1 SPC-m293 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.4 OC1=CC(Br)=CN=C1 SPC-t046 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.4 OC1=CC(Cl)=NC=C1 SPC-s856 [2,0,0,0,0,0|2,0,0]=4 168 B10R1.2 O=CC1=C(Cl)C(Cl)=NC=C1 SPC-u112 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.2 O=CC1=CC=CC(Br)=C1F SPC-t759 [1,1,0,0,0,0|1,0,0]=3 170 B10R1.2 O=CC1=CN=CC(Cl)=C1Cl SPC-p455 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.30 CC1=NC(C=O)=C(F)C=C1 SPC-r230 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 SPC-r401 [1,1,0,0,0,0|1,0,0]=3 173 B10R1.30 NC1=C(CO)C=C(Br)C=C1 SPC-j974 [1,1,0,0,0,0|1,0,1]=4 174 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 SPC-v716 [1,1,0,0,0,0|1,0,0]=3 175 B10R1.30 O=CC1=C(F)C=CC(Br)=N1 SPC-r176 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.30 O=CC1=CC(Br)=CN=C1Cl SPC-j645 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.30 O=CC1=CC(Br)=CN=C1F SPC-j351 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.30 O=CC1=CC(Br)=NC=C1F SPC-s839 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.172 COC1=CC(C=O)=CN=C1 SPC-g844 [1,1,0,0,0,0|1,0,0]=3 180 B10R1.172 COC1=NC=CC(C=O)=C1 SPC-h062 [1,1,0,0,0,0|1,0,0]=3 181 B10R1.172 N#CC1=CC(C=O)=CN=C1 SPC-r213 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.172 N#CC1=NC=CC(C=O)=C1 SPC-r186 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.176 CC1=C(F)C=CC(C=O)=N1 SPC-n216 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 SPC-t001 [1,1,0,0,0,0|1,0,0]=3 185 B10R1.13 CC1=CN=C(C(=O)O)C=N1 SPC-h803 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.13 CC1=CN=C(C(=O)O)N=C1 SPC-h567 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SPC-t870 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.13 NC(=O)C1=NC=C(O)C=C1 SPC-u527 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.13 NC1=CN=C(C(=O)O)C=C1 SPC-g569 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.13 NC1=CN=C(C(=O)O)N=C1 SPC-t633 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.13 NC1=NC=C(C(=O)O)C=C1 SPC-j431 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.13 NC1=NN=C(C(=O)O)C=C1 SPC-h063 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 SPC-k216 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 SPC-g051 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 SPC-g367 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 SPC-g701 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.13 O=C(O)C1=CN=C(F)C=C1 SPC-p809 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 SPC-g079 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 SPC-t053 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 SPC-k975 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.13 O=C(O)C1=NC=C(F)C=N1 SPC-h700 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SPC-g279 [1,1,0,0,0,0|1,0,0]=3 203 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 SPC-j945 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.13 O=C(O)C1=NN=C(O)C=C1 SPC-g471 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.13 O=C1C=CC(C(=O)O)=CO1 SPC-k150 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.13 OB(O)C1=CC=C(F)C=C1 SPC-q618 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.13 OB(O)C1=CC=C(O)C=C1 SPC-s693 [1,1,0,0,0,0|1,0,1]=4 208 B10R1.15 COC(=O)C1=CN=CN=C1 SPC-j093 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.15 COC(=O)C1=NC=CC=N1 SPC-g360 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.15 COC(=O)C1=NC=NC=C1 SPC-g743 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.15 COC(=O)C1=NN=CC=C1 SPC-g720 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SPC-t740 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.28 CC(C)(O)C1=CC=CC=C1 SPC-g210 [1,1,0,0,0,0|1,0,1]=4 214 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 SPC-n890 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 SPC-n891 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.61 CC(=O)C1=C(F)C=CC=N1 SPC-j546 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.61 CC(=O)C1=C(N)N=CC=C1 SPC-r191 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.61 CC(=O)C1=CC=CN=C1Cl SPC-j606 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SPC-g617 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.61 CC1=C(C(=O)O)C=NN=C1 SPC-j591 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.61 CC1=CN=CN=C1C(=O)O SPC-t697 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.61 CC1=NC=CN=C1C(=O)O SPC-j734 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.61 NC(=O)C1=C(N)C=CN=C1 SPC-p487 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.61 NC(=O)C1=C(N)C=CN=C1 SPC-s982 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.61 NC1=C(C(=O)O)C=NC=C1 SPC-g169 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.61 NC1=CC=CN=C1C(=O)O SPC-g425 [1,1,0,0,0,0|1,0,0]=3 227 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 SPC-g116 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 SPC-t006 [1,1,0,0,0,0|1,0,0]=3 229 B10R1.61 O=C(O)C1=C(F)C=CC=N1 SPC-g454 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.61 O=C(O)C1=C(F)C=NC=C1 SPC-g759 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.61 O=C(O)C1=C(F)C=NC=N1 SPC-t058 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.61 O=C(O)C1=CC=CN=C1Br SPC-m969 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.61 O=C(O)C1=NC=CC=C1O SPC-k065 [1,1,0,0,0,0|1,0,0]=3 234 B10R1.61 O=C(O)C1=NC=CN=C1Cl SPC-j425 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.61 O=C(O)C1=NC=CN=C1O SPC-g411 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.14 COC(=O)C1=CC(Br)=CN1 SPC-g315 [0,1,0,0,1,0|2,0,0]=4 237 B10R1.14 COC(=O)C1=CC(Br)=CS1 SPC-j659 [0,1,0,0,1,0|2,0,0]=4 238 B10R1.14 COC(=O)C1=CC(Cl)=CS1 SPC-k813 [0,1,0,0,1,0|2,0,0]=4 239 B10R1.14 COC(=O)C1=CC=C(Br)S1 SPC-j660 [0,1,0,0,1,0|2,0,0]=4 240 B10R1.14 COC(=O)C1=CC=C(N)O1 SPC-k486 [0,1,0,0,1,0|2,0,0]=4 241 B10R1.14 COC(=O)C1=CSC(Cl)=C1 SPC-k869 [0,1,0,0,1,0|2,0,0]=4 242 B10R1.194 CC1=CNC(C(=O)O)=C1C SPC-h485 [0,1,0,0,1,0|2,0,0]=4 243 B10R1.149 COC(=O)C1=C(Br)C=CN1 SPC-h459 [0,1,0,0,1,0|2,0,0]=4 244 B10R1.149 COC(=O)C1=C(Br)C=CS1 SPC-q115 [0,1,0,0,1,0|2,0,0]=4 245 B10R1.149 COC(=O)C1=C(C)C=CN1 SPC-m282 [0,1,0,0,1,0|2,0,0]=4 246 B10R1.149 COC(=O)C1=C(Cl)C=CN1 SPC-h158 [0,1,0,0,1,0|2,0,0]=4 247 B10R1.149 COC(=O)C1=C(N)C=CO1 SPC-n432 [0,1,0,0,1,0|2,0,0]=4 248 B10R1.149 COC(=O)C1=C(N)C=CO1 SPC-q853 [0,1,0,0,1,0|2,0,0]=4 249 B10R1.149 COC(=O)C1=C(N)SC=C1 SPC-j616 [0,1,0,0,1,0|2,0,0]=4 250 B10R1.149 COC(=O)C1=CNC=C1C SPC-k047 [0,1,0,0,1,0|2,0,0]=4 251 B10R1.149 COC(=O)C1=CSC=C1N SPC-u334 [0,1,0,0,1,0|2,0,0]=4 252 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 SPC-g090 [0,1,0,0,0,1|1,0,0]=3 253 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 SPC-u409 [0,1,0,0,0,1|2,0,0]=4 254 B12R1.50 COC(=O)CC1=CN=CC(C)=C1 SPC-m690 [0,1,0,0,0,1|2,0,0]=4 255 B12R1.127 O=C(O)CC1=C(Br)C=CC(Br)=C1 SPC-r011 [0,1,0,0,0,1|1,0,0]=3 256 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 SPC-u160 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.48 COC1=C(Cl)C=C(C(=O)O)N=C1 SPC-r180 [0,2,0,0,0,0|2,0,0]=4 258 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=N1 SPC-u454 [0,2,0,0,0,0|1,0,0]=3 259 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F SPC-h458 [0,2,0,0,0,0|1,0,0]=3 260 B12R1.367 COC(=O)C1=CC(=O)N(C)C=C1 SPC-j274 [0,2,0,0,0,0|1,0,1]=4 261 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 SPC-t211 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 SPC-h086 [0,2,0,0,0,0|2,0,0]=4 263 B12R1.367 COC(=O)C1=CN=C(I)C(O)=C1 SPC-t430 [0,2,0,0,0,0|1,0,0]=3 264 B12R1.367 COC(=O)C1=CN=C(O)C(O)=C1 SPC-m075 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 SPC-n444 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.367 COC(=O)C1=NC(O)=C(O)C=C1 SPC-t463 [0,2,0,0,0,0|1,0,0]=3 267 B12R1.367 COC(=O)C1=NC=C(N)C(C)=C1 SPC-m143 [0,2,0,0,0,0|2,0,0]=4 268 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 SPC-n442 [0,2,0,0,0,0|1,0,0]=3 269 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F SPC-m953 [0,2,0,0,0,0|1,0,0]=3 270 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1F SPC-t528 [0,2,0,0,0,0|1,0,0]=3 271 B12R1.893 O=C(O)C1=CN=C(Cl)C(F)=C1Cl SPC-p463 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl SPC-u237 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O SPC-s726 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.24 COC(=O)C1=C(N)C(C)=CC=C1 SPC-g734 [0,2,0,0,0,0|1,0,0]=3 275 B12R1.24 COC(=O)C1=C(N)C(C)=NC=C1 SPC-t209 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.24 COC(=O)C1=CC=CN(C)C1=O SPC-q089 [0,2,0,0,0,0|2,0,0]=4 277 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=N1 SPC-r190 [0,2,0,0,0,0|2,0,0]=4 278 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Cl SPC-t673 [0,2,0,0,0,0|2,0,0]=4 279 B12R1.354 COC(=O)C1=CC(Br)=CN=C1O SPC-g475 [0,2,0,0,0,0|2,0,0]=4 280 B12R1.354 COC(=O)C1=CC(Br)=NC=C1N SPC-q137 [0,2,0,0,0,0|2,0,0]=4 281 B12R1.354 COC(=O)C1=CC(Br)=NC=C1O SPC-q100 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.354 COC(=O)C1=CC(F)=CN=C1Cl SPC-n426 [0,2,0,0,0,0|2,0,0]=4 283 B12R1.354 COC(=O)C1=CC(O)=CN=C1Cl SPC-n427 [0,2,0,0,0,0|1,0,0]=3 284 B12R1.358 COC(=O)C1=CC(Br)=CC(N)=N1 SPC-t688 [0,2,0,0,0,0|2,0,0]=4 285 B12R1.358 COC(=O)C1=CC(Br)=NC(Br)=C1 SPC-r212 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.358 COC(=O)C1=CC(Br)=NC(C)=C1 SPC-m430 [0,2,0,0,0,0|2,0,0]=4 287 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 SPC-g450 [0,2,0,0,0,0|2,0,0]=4 288 B12R1.435 COC(=O)C1=CC=CC(CBr)=C1 SPC-t418 [0,2,0,0,0,0|1,0,0]=3 289 B12R1.435 COC(=O)C1=NC=CC(CCl)=C1 SPC-q122 [0,2,0,0,0,0|2,0,0]=4 290 B12R1.511 CN1C=C(Br)C=C(C(=O)O)C1=O SPC-h538 [0,2,0,0,0,0|2,0,0]=4 291 B12R1.511 NC1=CC(Cl)=NC(C(=O)O)=C1Cl SPC-u355 [0,2,0,0,0,0|2,0,0]=4 292 B12R1.440 COC1=CC=CC(C(=O)O)=C1N SPC-j946 [0,2,0,0,0,0|0,0,0]=2 293 B12R1.894 O=C(O)C1=C(Cl)C=CC(Br)=C1Cl SPC-m585 [0,2,0,0,0,0|1,0,0]=3 294 B12R1.453 COC1=CC(B(O)O)=C(F)C=C1 SPC-k213 [0,2,0,0,0,0|1,0,1]=4 295 B12R1.453 COC1=CC(C(=O)O)=C(N)C=N1 SPC-t027 [0,2,0,0,0,0|1,0,0]=3 296 B12R1.453 COC1=CN=C(Cl)C(C(=O)O)=C1 SPC-m975 [0,2,0,0,0,0|1,0,0]=3 297 B12R1.258 CC(C)C1=CC=CC(C(=O)O)=N1 SPC-m544 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 SPC-s528 [0,2,0,0,0,0|1,0,0]=3 299 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=N1 SPC-n496 [0,2,0,0,0,0|2,0,0]=4 300 B12R1.258 O=C(O)C1=CC(C(F)F)=NC=C1 SPC-d175 [0,2,0,0,0,0|2,0,0]=4 301 B12R1.258 O=C(O)C1=CC=CC(C(F)F)=N1 SPC-d183 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.258 O=C(O)C1=NC=CC([N+](=O)[O-])=C1 SPC-u294 [0,2,0,0,0,0|1,0,1]=4 303 B10R1.66 O=C(O)\C=C\C1=CC=CS1 SPC-k420 [0,0,1,1,0,0|0,1,0]=3 304 B12R2.202 NC1=NC2=CC=CC(O)=C2S1 SPC-p157 [0,0,0,1,0,1|1,1,0]=4 305 B12R2.202 O=C1CC2=C(I)C=CC=C2N1 SPC-s335 [0,0,0,1,0,1|2,0,0]=4 306 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 SPC-p502 [0,0,0,1,0,1|2,0,0]=4 307 B12R2.202 OC1=CC=CC2=C1SC(Cl)=N2 SPC-k137 [0,0,0,1,0,1|1,1,0]=4 308 B12R2.606 ClC1=CC2=C(C=C1)OC(Cl)=N2 SPC-p124 [0,0,0,1,0,1|2,0,0]=4 309 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SPC-u070 [0,0,0,1,0,1|2,0,0]=4 310 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 SPC-h316 [0,0,0,1,0,1|2,0,0]=4 311 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 SPC-k660 [0,0,0,1,0,1|2,0,0]=4 312 B12R2.606 NC1=NC2=C(C=CC(O)=C2)S1 SPC-p166 [0,0,0,1,0,1|1,1,0]=4 313 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 SPC-g349 [0,0,0,1,0,1|2,0,0]=4 314 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SPC-p794 [0,0,0,1,0,1|2,0,0]=4 315 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SPC-g276 [0,0,0,1,0,1|2,0,0]=4 316 B12R2.606 OC1=CC2=C(C=C1)N=C(Cl)S2 SPC-t581 [0,0,0,1,0,1|2,0,0]=4 317 B12R2.132 NC1=CC2=C(C=C1)CNC2=O SPC-h313 [0,1,0,1,0,0|2,0,0]=4 318 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 SPC-g292 [0,1,0,1,0,0|2,0,0]=4 319 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 SPC-g641 [0,1,0,1,0,0|2,0,0]=4 320 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 SPC-p765 [0,1,0,1,0,0|2,0,0]=4 321 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 SPC-s397 [0,1,0,1,0,0|2,0,0]=4 322 B12R2.132 O=C1OCC2=C1C=C(I)C=C2 SPC-p810 [0,1,0,1,0,0|1,0,0]=3 323 B12R2.196 NC1=CC=CC2=C1CNC2=O SPC-h606 [0,1,0,1,0,0|2,0,0]=4 324 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 SPC-g231 [0,1,0,1,0,0|2,0,0]=4 325 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 SPC-g553 [0,1,0,1,0,0|2,0,0]=4 326 B12R2.196 O=C1COC2=C(Br)C=CC=C12 SPC-s411 [0,1,0,1,0,0|1,0,0]=3 327 B12R2.2313 OC1=CC=CC(C2COC2)=C1 SPC-w003 [0,1,0,1,0,0|1,0,1]=4 328 B8R1.1 CC1=CC(C=O)=CS1 SPC-k319 [1,0,0,0,1,0|2,0,0]=4 329 B8R1.1 O=CC1=CC(Br)=CS1 SPC-t562 [1,0,0,0,1,0|2,0,0]=4 330 B8R1.1 O=CC1=CSC(Br)=C1 SPC-r371 [1,0,0,0,1,0|2,0,0]=4 331 B8R1.1 O=CC1=CSC(Cl)=C1 SPC-j711 [1,0,0,0,1,0|2,0,0]=4 332 B8R1.11 CC1=CSC=C1C=O SPC-p593 [1,0,0,0,1,0|2,0,0]=4 333 B8R1.7 CC(=O)C1=CSC=C1 SPC-g143 [1,0,0,0,1,0|2,0,0]=4 334 B8R1.7 O=C(O)C1=CC=CN1 SPC-g146 [1,0,0,0,1,0|1,0,0]=3 335 B8R1.7 O=C(O)C1=CNN=C1 SPC-g179 [1,0,0,0,1,0|2,0,0]=4 336 B8R1.7 O=C(O)C1=COC=C1 SPC-n400 [1,0,0,0,1,0|1,0,0]=3 337 B8R1.7 O=C(O)C1=COC=N1 SPC-g687 [1,0,0,0,1,0|2,0,0]=4 338 B8R1.7 O=C(O)C1=CSN=C1 SPC-r366 [1,0,0,0,1,0|2,0,0]=4 339 B8R1.7 O=C(O)C1=NNC=C1 SPC-g199 [1,0,0,0,1,0|2,0,0]=4 340 B10R1.18 O=C(O)CC1=CN=NC=C1 SPC-j090 [1,0,0,0,0,1|2,0,0]=4