0 B6R1.2 BrC1=CC=NN1 SPC-n183 [0,0,0,0,0,0|3,0,0]=3 1 B6R1.2 BrC1=NC=NN1 SPC-g148 [0,0,0,0,0,0|4,0,0]=4 2 B6R1.2 BrC1=NN=CS1 SPC-h716 [0,0,0,0,0,0|4,0,0]=4 3 B6R1.2 CC1=CNC=C1 SPC-m068 [0,0,0,0,0,0|1,0,0]=1 4 B6R1.2 CC1=CNN=C1 SPC-n152 [0,0,0,0,0,0|0,0,0]=0 5 B6R1.2 CC1=COC=N1 SPC-n151 [0,0,0,0,0,0|3,0,0]=3 6 B6R1.2 CC1=CSC=N1 SPC-g112 [0,0,0,0,0,0|3,0,0]=3 7 B6R1.2 ClC1=CSC=C1 SPC-t726 [0,0,0,0,0,0|3,0,0]=3 8 B6R1.2 ClC1=CSC=N1 SPC-n125 [0,0,0,0,0,0|4,0,0]=4 9 B6R1.2 ClC1=NNC=C1 SPC-j937 [0,0,0,0,0,0|3,0,0]=3 10 B6R1.2 FC1=CNN=C1 SPC-k134 [0,0,0,0,0,0|1,0,0]=1 11 B6R1.2 FC1=NNC=C1 SPC-j936 [0,0,0,0,0,0|3,0,0]=3 12 B6R1.2 IC1=CC=NN1 SPC-p388 [0,0,0,0,0,0|3,0,0]=3 13 B6R1.2 IC1=CNN=C1 SPC-g139 [0,0,0,0,0,0|1,0,0]=1 14 B6R1.2 IC1=COCC1 SPC-t718 [0,0,0,0,0,0|3,0,1]=4 15 B6R1.2 NC1=CC=NN1 SPC-g055 [0,0,0,0,0,0|3,0,0]=3 16 B6R1.2 NC1=CN=CS1 SPC-u196 [0,0,0,0,0,0|3,0,0]=3 17 B6R1.2 NC1=CNN=C1 SPC-p006 [0,0,0,0,0,0|1,0,0]=1 18 B6R1.2 NC1=CSN=C1 SPC-r370 [0,0,0,0,0,0|2,0,0]=2 19 B6R1.2 NC1=NOC=C1 SPC-j749 [0,0,0,0,0,0|4,0,0]=4 20 B6R1.2 NN1C=CC=C1 SPC-j724 [0,0,0,0,0,0|4,0,0]=4 21 B6R1.2 O=C1C=CCC1 SPC-g207 [0,0,0,0,0,0|3,0,1]=4 22 B6R1.2 O=C1C=CCO1 SPC-t619 [0,0,0,0,0,0|4,0,0]=4 23 B6R1.2 O=C1C=CNN1 SPC-p382 [0,0,0,0,0,0|3,0,0]=3 24 B6R1.2 O=C1CCNC1 SPC-g182 [0,0,0,0,0,0|2,0,2]=4 25 B6R1.2 S=C1N=CNN1 SPC-s197 [0,0,0,0,0,0|4,0,0]=4 26 B5R1.1 C1=COC=N1 SPC-m896 [1,0,0,0,0,0|2,0,0]=3 27 B7R1.1 BrCC1=CCCC1 SPC-n905 [0,1,0,0,0,0|2,0,1]=4 28 B7R1.1 C#CC1=CNN=C1 SPC-n145 [0,1,0,0,0,0|0,0,1]=2 29 B7R1.1 COC1=CNN=C1 SPC-p580 [0,1,0,0,0,0|0,0,0]=1 30 B7R1.1 ClCC1=CSC=N1 SPC-g086 [0,1,0,0,0,0|3,0,0]=4 31 B7R1.1 N#CC1=CNN=C1 SPC-h236 [0,1,0,0,0,0|0,0,1]=2 32 B7R1.1 NCC1=CN=CO1 SPC-u502 [0,1,0,0,0,0|2,0,0]=3 33 B7R1.1 NCC1=CN=CS1 SPC-n637 [0,1,0,0,0,0|2,0,0]=3 34 B7R1.1 NCC1=CNC=N1 SPC-n641 [0,1,0,0,0,0|2,0,0]=3 35 B7R1.1 NCC1=CNN=C1 SPC-h529 [0,1,0,0,0,0|0,0,0]=1 36 B7R1.1 NCC1=CNN=C1 SPC-u445 [0,1,0,0,0,0|0,0,0]=1 37 B7R1.1 NCC1=COC=N1 SPC-n934 [0,1,0,0,0,0|3,0,0]=4 38 B7R1.1 NCC1=CON=C1 SPC-t984 [0,1,0,0,0,0|1,0,0]=2 39 B7R1.1 NCC1=NOC=C1 SPC-k851 [0,1,0,0,0,0|3,0,0]=4 40 B7R1.1 O=CC1=CC=NN1 SPC-p008 [0,1,0,0,0,0|2,0,1]=4 41 B7R1.1 O=CC1=CN=CS1 SPC-s113 [0,1,0,0,0,0|2,0,1]=4 42 B7R1.1 O=CC1=CNN=C1 SPC-g855 [0,1,0,0,0,0|0,0,1]=2 43 B7R1.1 O=CC1=CNN=C1 SPC-k121 [0,1,0,0,0,0|0,0,1]=2 44 B7R1.1 O=CC1=CSC=C1 SPC-g519 [0,1,0,0,0,0|2,0,1]=4 45 B7R1.1 OCC1=CNC=N1 SPC-s789 [0,1,0,0,0,0|2,0,0]=3 46 B7R1.1 OCC1=CNN=C1 SPC-j657 [0,1,0,0,0,0|0,0,0]=1 47 B7R1.1 OCC1=COC=N1 SPC-k823 [0,1,0,0,0,0|3,0,0]=4 48 B7R1.1 OCC1=NNC=C1 SPC-j656 [0,1,0,0,0,0|2,0,0]=3 49 B7R1.1 OCC1=NOC=C1 SPC-k850 [0,1,0,0,0,0|3,0,0]=4 50 B7R1.2 BrC1=CC(Br)=NN1 SPC-s266 [0,1,0,0,0,0|3,0,0]=4 51 B7R1.2 BrC1=CN=C(I)N1 SPC-t039 [0,1,0,0,0,0|3,0,0]=4 52 B7R1.2 CC1=CC(Cl)=NN1 SPC-j294 [0,1,0,0,0,0|2,0,0]=3 53 B7R1.2 CC1=CC(N)=NN1 SPC-g654 [0,1,0,0,0,0|2,0,0]=3 54 B7R1.2 CC1=CN(C)N=C1 SPC-s115 [0,1,0,0,0,0|0,0,0]=1 55 B7R1.2 CC1=NN(C)C=C1 SPC-g247 [0,1,0,0,0,0|2,0,0]=3 56 B7R1.2 CC1=NNC(C)=N1 SPC-j293 [0,1,0,0,0,0|3,0,0]=4 57 B7R1.2 CN1C=C(Br)C=N1 SPC-g070 [0,1,0,0,0,0|1,0,0]=2 58 B7R1.2 CN1C=C(I)C=N1 SPC-g007 [0,1,0,0,0,0|1,0,0]=2 59 B7R1.2 CN1C=C(N)C=N1 SPC-g585 [0,1,0,0,0,0|1,0,0]=2 60 B7R1.2 CN1C=C(N)C=N1 SPC-p030 [0,1,0,0,0,0|1,0,0]=2 61 B7R1.2 CN1C=CC(Br)=N1 SPC-g829 [0,1,0,0,0,0|3,0,0]=4 62 B7R1.2 CN1C=CC(Cl)=N1 SPC-v037 [0,1,0,0,0,0|3,0,0]=4 63 B7R1.2 CN1C=CC(I)=N1 SPC-u127 [0,1,0,0,0,0|3,0,0]=4 64 B7R1.2 CN1C=C[N+](C)=C1 SPC-m458 [0,1,0,0,0,0|2,0,0]=3 65 B7R1.2 CN1C=NC(I)=C1 SPC-g586 [0,1,0,0,0,0|2,0,0]=3 66 B7R1.2 FC1=CN=C(Br)S1 SPC-m590 [0,1,0,0,0,0|3,0,0]=4 67 B7R1.2 NC1=CC(Br)=NN1 SPC-k030 [0,1,0,0,0,0|3,0,0]=4 68 B7R1.2 NC1=CC(Cl)=NN1 SPC-j892 [0,1,0,0,0,0|3,0,0]=4 69 B7R1.2 NC1=CC(F)=NN1 SPC-h042 [0,1,0,0,0,0|3,0,0]=4 70 B7R1.2 NC1=CC(O)=NN1 SPC-n036 [0,1,0,0,0,0|3,0,0]=4 71 B7R1.2 NC1=CSC(Cl)=C1 SPC-k871 [0,1,0,0,0,0|3,0,0]=4 72 B7R1.2 NC1=NC=C(Cl)S1 SPC-m588 [0,1,0,0,0,0|3,0,0]=4 73 B7R1.2 NC1=NC=C(F)S1 SPC-m589 [0,1,0,0,0,0|3,0,0]=4 74 B7R1.2 NC1=NC=C(F)S1 SPC-n215 [0,1,0,0,0,0|3,0,0]=4 75 B7R1.4 BrC1=C(I)C=NN1 SPC-m504 [0,1,0,0,0,0|1,0,0]=2 76 B7R1.4 CC1=C(Br)NN=C1 SPC-i582 [0,1,0,0,0,0|0,0,0]=1 77 B7R1.4 CC1=C(C)NN=C1 SPC-s309 [0,1,0,0,0,0|0,0,0]=1 78 B7R1.4 CC1=C(Cl)N=CN1 SPC-q880 [0,1,0,0,0,0|2,0,0]=3 79 B7R1.4 CC1=C(N)NN=C1 SPC-h585 [0,1,0,0,0,0|0,0,0]=1 80 B7R1.4 CC1=C(N)SC=N1 SPC-u799 [0,1,0,0,0,0|3,0,0]=4 81 B7R1.4 CC1=CSC=C1N SPC-p592 [0,1,0,0,0,0|2,0,0]=3 82 B7R1.4 CN1N=CC=C1N SPC-s781 [0,1,0,0,0,0|3,0,0]=4 83 B7R1.4 ClC1=C(Br)NN=C1 SPC-v128 [0,1,0,0,0,0|1,0,0]=2 84 B7R1.4 ClC1=C(I)SC=C1 SPC-u292 [0,1,0,0,0,0|3,0,0]=4 85 B7R1.4 FC1=C(Br)NN=C1 SPC-u034 [0,1,0,0,0,0|1,0,0]=2 86 B7R1.4 FC1=NNC=C1Br SPC-m495 [0,1,0,0,0,0|1,0,0]=2 87 B7R1.4 NC1=C(Br)C=NN1 SPC-g516 [0,1,0,0,0,0|1,0,0]=2 88 B7R1.4 NC1=CNN=C1N SPC-j423 [0,1,0,0,0,0|1,0,0]=2 89 B7R1.4 NC1=CSC=C1Br SPC-n124 [0,1,0,0,0,0|3,0,0]=4 90 B5R1.2 CC1CNC1 SPC-h149 [0,0,0,0,1,0|0,0,3]=4 91 B5R1.2 C[C@H]1CCN1 SPC-i601 [0,0,0,0,1,0|1,0,2]=4 92 B5R1.2 O=C1CCN1 SPC-t120 [0,0,0,0,1,0|2,0,1]=4 93 B5R1.2 O=C1CNC1 SPC-h722 [0,0,0,0,1,0|1,0,2]=4 94 B7R1.3 BrC1=CC=NC=C1 SPC-k219 [0,0,0,0,0,1|2,0,0]=3 95 B7R1.3 BrC1=CN=CN=C1 SPC-g345 [0,0,0,0,0,1|1,0,1]=3 96 B7R1.3 BrC1=NN=CC=C1 SPC-t686 [0,0,0,0,0,1|3,0,0]=4 97 B7R1.3 CC1=CC=CN=N1 SPC-g427 [0,0,0,0,0,1|2,0,0]=3 98 B7R1.3 CC1=CCCNC1 SPC-m637 [0,0,0,0,0,1|1,0,1]=3 99 B7R1.3 CC1=CCNCC1 SPC-h455 [0,0,0,0,0,1|1,0,1]=3 100 B7R1.3 CC1=CN=NC=C1 SPC-g520 [0,0,0,0,0,1|0,0,1]=2 101 B7R1.3 CC1=NC=CC=N1 SPC-u374 [0,0,0,0,0,1|3,0,0]=4 102 B7R1.3 CC1=NC=NC=C1 SPC-g053 [0,0,0,0,0,1|1,0,0]=2 103 B7R1.3 ClC1=NN=CC=C1 SPC-h220 [0,0,0,0,0,1|3,0,0]=4 104 B7R1.3 FC1=NC=CC=C1 SPC-m992 [0,0,0,0,0,1|3,0,0]=4 105 B7R1.3 IC1=NC=CN=C1 SPC-m717 [0,0,0,0,0,1|2,0,0]=3 106 B7R1.3 NC1=CC=CN=N1 SPC-j168 [0,0,0,0,0,1|3,0,0]=4 107 B7R1.3 NC1=CN=NC=C1 SPC-j087 [0,0,0,0,0,1|1,0,1]=3 108 B7R1.3 NC1=CN=NC=C1 SPC-u396 [0,0,0,0,0,1|1,0,1]=3 109 B7R1.3 NC1=NC=CN=C1 SPC-g316 [0,0,0,0,0,1|2,0,0]=3 110 B7R1.3 O=C1C=CC=NN1 SPC-g446 [0,0,0,0,0,1|3,0,0]=4 111 B7R1.3 O=C1C=CN=CN1 SPC-n087 [0,0,0,0,0,1|2,0,0]=3 112 B7R1.3 OC1=CC=NC=C1 SPC-g124 [0,0,0,0,0,1|2,0,0]=3 113 B7R1.3 OC1=CN=CN=C1 SPC-k979 [0,0,0,0,0,1|1,0,1]=3 114 B7R1.3 [O-]C1=CC=CC=C1 SPC-k243 [0,0,0,0,0,1|3,0,0]=4 115 B7R1.3 [S-]C1=CC=CC=C1 SPC-t743 [0,0,0,0,0,1|3,0,0]=4 116 B7R1.3 [SiH3]C1=CC=CC=C1 SPC-r404 [0,0,0,0,0,1|2,1,0]=4 117 B4R0.1 CC(=O)CN SPC-t886 [1,0,1,0,0,0|1,0,1]=4 118 B8R1.2 C#CC1=CC=NC=C1 SPC-g714 [0,1,0,0,0,1|1,0,1]=4 119 B8R1.2 C#CC1=NC=CN=C1 SPC-v626 [0,1,0,0,0,1|1,0,1]=4 120 B8R1.2 CNC1=CN=CN=C1 SPC-q202 [0,1,0,0,0,1|0,0,1]=3 121 B8R1.2 ClCC1=CN=CN=C1 SPC-g979 [0,1,0,0,0,1|0,0,1]=3 122 B8R1.2 ClCC1=NC=CN=C1 SPC-i698 [0,1,0,0,0,1|1,0,0]=3 123 B8R1.2 ClCC1=NN=CC=C1 SPC-j100 [0,1,0,0,0,1|2,0,0]=4 124 B8R1.2 N#CC1=CN=CN=C1 SPC-j092 [0,1,0,0,0,1|0,0,2]=4 125 B8R1.2 N#CC1=CN=NC=C1 SPC-j089 [0,1,0,0,0,1|0,0,2]=4 126 B8R1.2 NCC1=CC=CN=N1 SPC-j018 [0,1,0,0,0,1|2,0,0]=4 127 B8R1.2 NCC1=CC=CN=N1 SPC-q241 [0,1,0,0,0,1|2,0,0]=4 128 B8R1.2 NCC1=CC=NC=C1 SPC-k269 [0,1,0,0,0,1|1,0,0]=3 129 B8R1.2 NCC1=CN=CN=C1 SPC-m828 [0,1,0,0,0,1|0,0,1]=3 130 B8R1.2 NCC1=CN=NC=C1 SPC-j016 [0,1,0,0,0,1|0,0,1]=3 131 B8R1.2 NCC1=NC=CN=C1 SPC-j017 [0,1,0,0,0,1|1,0,0]=3 132 B8R1.2 NCC1=NC=NC=C1 SPC-j019 [0,1,0,0,0,1|1,0,0]=3 133 B8R1.2 NCC1=NC=NC=C1 SPC-j020 [0,1,0,0,0,1|1,0,0]=3 134 B8R1.2 NNC1=CC=CN=C1 SPC-g939 [0,1,0,0,0,1|2,0,0]=4 135 B8R1.2 NNC1=CC=NC=C1 SPC-g941 [0,1,0,0,0,1|2,0,0]=4 136 B8R1.2 NNC1=NC=CN=C1 SPC-g338 [0,1,0,0,0,1|2,0,0]=4 137 B8R1.2 O=CC1=CN=CC=C1 SPC-g255 [0,1,0,0,0,1|1,0,1]=4 138 B8R1.2 O=CC1=CN=CN=C1 SPC-j129 [0,1,0,0,0,1|0,0,2]=4 139 B8R1.2 O=CC1=CN=NC=C1 SPC-n491 [0,1,0,0,0,1|0,0,2]=4 140 B8R1.2 O=CC1=NC=CN=C1 SPC-j095 [0,1,0,0,0,1|1,0,1]=4 141 B8R1.2 OCC1=CN=CC=C1 SPC-g084 [0,1,0,0,0,1|1,0,0]=3 142 B8R1.2 OCC1=CN=CN=C1 SPC-g744 [0,1,0,0,0,1|0,0,1]=3 143 B8R1.2 OCC1=CN=NC=C1 SPC-j088 [0,1,0,0,0,1|0,0,1]=3 144 B8R1.2 OCC1=NC=CN=C1 SPC-g622 [0,1,0,0,0,1|1,0,0]=3 145 B8R1.2 OCC1=NC=NC=C1 SPC-g987 [0,1,0,0,0,1|1,0,0]=3 146 B8R1.2 OCC1=NN=CC=C1 SPC-g951 [0,1,0,0,0,1|2,0,0]=4 147 B8R1.3 BrC1=CN=C(I)C=C1 SPC-k218 [0,1,0,0,0,1|2,0,0]=4 148 B8R1.3 BrC1=CN=C(I)C=N1 SPC-h114 [0,1,0,0,0,1|2,0,0]=4 149 B8R1.3 BrC1=CN=C(I)N=C1 SPC-g265 [0,1,0,0,0,1|1,0,1]=4 150 B8R1.3 BrC1=NC=C(I)C=C1 SPC-s842 [0,1,0,0,0,1|2,0,0]=4 151 B8R1.3 CC1=CC=C(N)N=N1 SPC-h103 [0,1,0,0,0,1|2,0,0]=4 152 B8R1.3 CC1=CN=C(Br)C=C1 SPC-g114 [0,1,0,0,0,1|1,0,0]=3 153 B8R1.3 CC1=CN=C(Br)C=N1 SPC-v711 [0,1,0,0,0,1|1,0,0]=3 154 B8R1.3 CC1=CN=C(Cl)N=C1 SPC-g406 [0,1,0,0,0,1|0,0,1]=3 155 B8R1.3 CC1=CN=C(F)C=C1 SPC-s869 [0,1,0,0,0,1|1,0,0]=3 156 B8R1.3 CC1=CN=C(N)C=N1 SPC-n222 [0,1,0,0,0,1|1,0,0]=3 157 B8R1.3 CC1=NC=C(Br)C=C1 SPC-p658 [0,1,0,0,0,1|2,0,0]=4 158 B8R1.3 CC1=NC=C(Br)C=N1 SPC-g647 [0,1,0,0,0,1|1,0,1]=4 159 B8R1.3 CC1=NC=C(N)C=C1 SPC-n264 [0,1,0,0,0,1|2,0,0]=4 160 B8R1.3 CC1=NC=C(N)C=N1 SPC-j252 [0,1,0,0,0,1|1,0,1]=4 161 B8R1.3 CC1=NC=C(O)C=N1 SPC-r244 [0,1,0,0,0,1|1,0,1]=4 162 B8R1.3 CC1=NN=C(Br)C=C1 SPC-j827 [0,1,0,0,0,1|2,0,0]=4 163 B8R1.3 CC1=NN=C(Cl)C=C1 SPC-g259 [0,1,0,0,0,1|2,0,0]=4 164 B8R1.3 CC1=NN=C(I)C=C1 SPC-j592 [0,1,0,0,0,1|2,0,0]=4 165 B8R1.3 CC1=NN=C(O)C=C1 SPC-g136 [0,1,0,0,0,1|2,0,0]=4 166 B8R1.3 CC1=NN=C(O)C=C1 SPC-t081 [0,1,0,0,0,1|2,0,0]=4 167 B8R1.3 ClC1=CN=C(Br)N=C1 SPC-k232 [0,1,0,0,0,1|1,0,1]=4 168 B8R1.3 ClC1=CN=C(Cl)C=N1 SPC-g707 [0,1,0,0,0,1|2,0,0]=4 169 B8R1.3 ClC1=CN=C(Cl)N=C1 SPC-g383 [0,1,0,0,0,1|1,0,1]=4 170 B8R1.3 ClC1=NC=C(I)C=C1 SPC-t655 [0,1,0,0,0,1|2,0,0]=4 171 B8R1.3 ClC1=NC=C(I)C=N1 SPC-p201 [0,1,0,0,0,1|1,0,1]=4 172 B8R1.3 FC1=CN=C(Br)C=C1 SPC-s838 [0,1,0,0,0,1|2,0,0]=4 173 B8R1.3 FC1=CN=C(Br)N=C1 SPC-h324 [0,1,0,0,0,1|1,0,1]=4 174 B8R1.3 FC1=CN=C(Cl)C=C1 SPC-s857 [0,1,0,0,0,1|2,0,0]=4 175 B8R1.3 FC1=CN=C(Cl)N=C1 SPC-g142 [0,1,0,0,0,1|1,0,1]=4 176 B8R1.3 FC1=NC=C(Br)C=C1 SPC-p654 [0,1,0,0,0,1|2,0,0]=4 177 B8R1.3 FC1=NC=C(I)C=N1 SPC-r253 [0,1,0,0,0,1|1,0,1]=4 178 B8R1.3 NC1=CN=C(Br)C=N1 SPC-g133 [0,1,0,0,0,1|2,0,0]=4 179 B8R1.3 NC1=CN=C(Cl)C=N1 SPC-g543 [0,1,0,0,0,1|2,0,0]=4 180 B8R1.3 NC1=CN=C(Cl)N=C1 SPC-g753 [0,1,0,0,0,1|1,0,1]=4 181 B8R1.3 NC1=CN=C(F)C=C1 SPC-t078 [0,1,0,0,0,1|2,0,0]=4 182 B8R1.3 NC1=NC=C(Cl)C=C1 SPC-t406 [0,1,0,0,0,1|2,0,0]=4 183 B8R1.3 NC1=NC=C(F)C=C1 SPC-g172 [0,1,0,0,0,1|2,0,0]=4 184 B8R1.3 NC1=NC=C(O)C=N1 SPC-h124 [0,1,0,0,0,1|1,0,1]=4 185 B8R1.3 O=C1N=CC(Br)=CN1 SPC-t737 [0,1,0,0,0,1|1,0,0]=3 186 B8R1.3 OC1=CN=C(Br)C=C1 SPC-g192 [0,1,0,0,0,1|2,0,0]=4 187 B8R1.3 OC1=CN=C(Br)N=C1 SPC-h179 [0,1,0,0,0,1|1,0,1]=4 188 B8R1.3 OC1=CN=C(Cl)C=C1 SPC-g273 [0,1,0,0,0,1|2,0,0]=4 189 B8R1.3 OC1=CN=C(Cl)N=C1 SPC-g467 [0,1,0,0,0,1|1,0,1]=4 190 B8R1.4 BrC1=CC(Br)=NC=N1 SPC-p457 [0,1,0,0,0,1|2,0,0]=4 191 B8R1.4 BrC1=NC=CC(I)=C1 SPC-r426 [0,1,0,0,0,1|2,0,0]=4 192 B8R1.4 CC1=CC(=O)NN=C1 SPC-t626 [0,1,0,0,0,1|0,0,0]=2 193 B8R1.4 CC1=CC(Br)=CN=C1 SPC-g551 [0,1,0,0,0,1|1,0,0]=3 194 B8R1.4 CC1=CC(C)=NC=N1 SPC-n162 [0,1,0,0,0,1|1,0,0]=3 195 B8R1.4 CC1=CC(Cl)=NC=C1 SPC-g113 [0,1,0,0,0,1|1,0,0]=3 196 B8R1.4 CC1=CC(Cl)=NC=N1 SPC-g729 [0,1,0,0,0,1|1,0,0]=3 197 B8R1.4 CC1=CC(Cl)=NN=C1 SPC-h439 [0,1,0,0,0,1|0,0,1]=3 198 B8R1.4 CC1=CC(O)=CN=C1 SPC-t060 [0,1,0,0,0,1|1,0,0]=3 199 B8R1.4 CC1=CC=CC(Cl)=N1 SPC-s860 [0,1,0,0,0,1|2,0,0]=4 200 B8R1.4 CC1=CC=NC(Cl)=N1 SPC-g317 [0,1,0,0,0,1|1,0,0]=3 201 B8R1.4 CC1=CC=NC(N)=N1 SPC-t018 [0,1,0,0,0,1|1,0,0]=3 202 B8R1.4 CC1=NC=CC(Br)=C1 SPC-n114 [0,1,0,0,0,1|2,0,0]=4 203 B8R1.4 CC1=NC=CC(Cl)=N1 SPC-m107 [0,1,0,0,0,1|2,0,0]=4 204 B8R1.4 CC1=NC=CC(N)=C1 SPC-m998 [0,1,0,0,0,1|2,0,0]=4 205 B8R1.4 CC1=NC=CC(O)=C1 SPC-r417 [0,1,0,0,0,1|2,0,0]=4 206 B8R1.4 ClC1=CC(Br)=CN=C1 SPC-s917 [0,1,0,0,0,1|2,0,0]=4 207 B8R1.4 ClC1=CC(Br)=CN=N1 SPC-n192 [0,1,0,0,0,1|1,0,1]=4 208 B8R1.4 ClC1=CC(Br)=NC=C1 SPC-j180 [0,1,0,0,0,1|2,0,0]=4 209 B8R1.4 ClC1=CC(Cl)=NC=C1 SPC-n018 [0,1,0,0,0,1|2,0,0]=4 210 B8R1.4 ClC1=CC(Cl)=NN=C1 SPC-r169 [0,1,0,0,0,1|1,0,1]=4 211 B8R1.4 ClC1=CC=NC(Br)=N1 SPC-p187 [0,1,0,0,0,1|2,0,0]=4 212 B8R1.4 ClC1=CC=NC(Cl)=N1 SPC-n019 [0,1,0,0,0,1|2,0,0]=4 213 B8R1.4 ClC1=CN=CC(Cl)=C1 SPC-k264 [0,1,0,0,0,1|2,0,0]=4 214 B8R1.4 ClC1=NC=CC(Br)=C1 SPC-p504 [0,1,0,0,0,1|2,0,0]=4 215 B8R1.4 FC1=CC(Br)=CN=C1 SPC-t612 [0,1,0,0,0,1|2,0,0]=4 216 B8R1.4 FC1=CC(Br)=NC=C1 SPC-r428 [0,1,0,0,0,1|2,0,0]=4 217 B8R1.4 FC1=CC(Cl)=NC=C1 SPC-s855 [0,1,0,0,0,1|2,0,0]=4 218 B8R1.4 FC1=CC(F)=NC=C1 SPC-g477 [0,1,0,0,0,1|2,0,0]=4 219 B8R1.4 FC1=NC=CC(Cl)=C1 SPC-t603 [0,1,0,0,0,1|2,0,0]=4 220 B8R1.4 FC1=NC=CC(Cl)=N1 SPC-u845 [0,1,0,0,0,1|2,0,0]=4 221 B8R1.4 FC1=NC=CC(I)=C1 SPC-m989 [0,1,0,0,0,1|2,0,0]=4 222 B8R1.4 IC1=CN=CC(I)=C1 SPC-k175 [0,1,0,0,0,1|2,0,0]=4 223 B8R1.4 NC1=CC(=O)NC=C1 SPC-g876 [0,1,0,0,0,1|2,0,0]=4 224 B8R1.4 NC1=CC(=O)NN=C1 SPC-u084 [0,1,0,0,0,1|1,0,0]=3 225 B8R1.4 NC1=CC(Br)=NC=C1 SPC-j715 [0,1,0,0,0,1|2,0,0]=4 226 B8R1.4 NC1=CC(Cl)=CN=C1 SPC-t052 [0,1,0,0,0,1|2,0,0]=4 227 B8R1.4 NC1=CC(Cl)=CN=N1 SPC-q561 [0,1,0,0,0,1|1,0,1]=4 228 B8R1.4 NC1=CC(Cl)=NC=C1 SPC-j364 [0,1,0,0,0,1|2,0,0]=4 229 B8R1.4 NC1=CC(Cl)=NC=N1 SPC-n258 [0,1,0,0,0,1|2,0,0]=4 230 B8R1.4 NC1=CC(Cl)=NN=C1 SPC-p801 [0,1,0,0,0,1|1,0,1]=4 231 B8R1.4 NC1=CC(F)=CN=C1 SPC-t057 [0,1,0,0,0,1|2,0,0]=4 232 B8R1.4 NC1=CC(F)=NC=C1 SPC-j716 [0,1,0,0,0,1|2,0,0]=4 233 B8R1.4 NC1=CC=NC(Cl)=N1 SPC-g077 [0,1,0,0,0,1|2,0,0]=4 234 B8R1.4 NC1=CC=NC(F)=N1 SPC-m993 [0,1,0,0,0,1|2,0,0]=4 235 B8R1.4 NC1=CN=CC(Cl)=N1 SPC-g175 [0,1,0,0,0,1|2,0,0]=4 236 B8R1.4 NC1=NC=CC(=O)N1 SPC-j367 [0,1,0,0,0,1|2,0,0]=4 237 B8R1.4 NC1=NC=CC(Br)=C1 SPC-g250 [0,1,0,0,0,1|2,0,0]=4 238 B8R1.4 NC1=NC=CC(Br)=N1 SPC-h132 [0,1,0,0,0,1|2,0,0]=4 239 B8R1.4 NC1=NC=CC(Cl)=C1 SPC-g189 [0,1,0,0,0,1|2,0,0]=4 240 B8R1.4 NC1=NC=CC(Cl)=N1 SPC-g272 [0,1,0,0,0,1|2,0,0]=4 241 B8R1.4 NC1=NC=CC(F)=C1 SPC-p570 [0,1,0,0,0,1|2,0,0]=4 242 B8R1.4 NC1=NC=CC(F)=N1 SPC-p571 [0,1,0,0,0,1|2,0,0]=4 243 B8R1.4 NC1=NC=CC(I)=C1 SPC-n148 [0,1,0,0,0,1|2,0,0]=4 244 B8R1.4 O=C1C=C(Br)C=CN1 SPC-m293 [0,1,0,0,0,1|2,0,0]=4 245 B8R1.4 O=C1C=C(I)C=NN1 SPC-t925 [0,1,0,0,0,1|1,0,0]=3 246 B8R1.4 OC1=CC(Br)=CN=C1 SPC-t046 [0,1,0,0,0,1|2,0,0]=4 247 B8R1.4 OC1=CC(Cl)=NC=C1 SPC-s856 [0,1,0,0,0,1|2,0,0]=4 248 B8R1.5 CC1=C(Br)C=CC=N1 SPC-s912 [0,1,0,0,0,1|2,0,0]=4 249 B8R1.5 CC1=C(Br)C=CN=C1 SPC-g505 [0,1,0,0,0,1|1,0,0]=3 250 B8R1.5 CC1=C(N)C=NC=C1 SPC-t017 [0,1,0,0,0,1|1,0,0]=3 251 B8R1.5 CC1=C(O)C=CC=N1 SPC-g264 [0,1,0,0,0,1|2,0,0]=4 252 B8R1.5 CC1=CC=CN=C1Br SPC-g509 [0,1,0,0,0,1|1,0,0]=3 253 B8R1.5 CC1=CC=CN=C1Cl SPC-k262 [0,1,0,0,0,1|1,0,0]=3 254 B8R1.5 CC1=CC=NN=C1Cl SPC-h437 [0,1,0,0,0,1|0,0,1]=3 255 B8R1.5 CC1=CC=NN=C1Cl SPC-m082 [0,1,0,0,0,1|0,0,1]=3 256 B8R1.5 CC1=CC=NNC1=O SPC-m081 [0,1,0,0,0,1|0,0,0]=2 257 B8R1.5 CC1=NC=CN=C1N SPC-s947 [0,1,0,0,0,1|1,0,0]=3 258 B8R1.5 CC1=NC=NC=C1N SPC-k927 [0,1,0,0,0,1|1,0,0]=3 259 B8R1.5 ClC1=C(Br)C=CC=N1 SPC-g036 [0,1,0,0,0,1|2,0,0]=4 260 B8R1.5 ClC1=C(Br)C=NC=C1 SPC-g430 [0,1,0,0,0,1|2,0,0]=4 261 B8R1.5 ClC1=C(Br)C=NC=N1 SPC-g929 [0,1,0,0,0,1|1,0,1]=4 262 B8R1.5 ClC1=C(I)C=NC=N1 SPC-g915 [0,1,0,0,0,1|1,0,1]=4 263 B8R1.5 ClC1=CC=NN=C1Cl SPC-n086 [0,1,0,0,0,1|1,0,1]=4 264 B8R1.5 FC1=C(Br)C=CN=C1 SPC-n115 [0,1,0,0,0,1|2,0,0]=4 265 B8R1.5 FC1=C(Br)C=NC=C1 SPC-u344 [0,1,0,0,0,1|2,0,0]=4 266 B8R1.5 FC1=C(I)C=CC=N1 SPC-s866 [0,1,0,0,0,1|2,0,0]=4 267 B8R1.5 FC1=C(I)C=CN=C1 SPC-j548 [0,1,0,0,0,1|2,0,0]=4 268 B8R1.5 FC1=CC=CN=C1Br SPC-p185 [0,1,0,0,0,1|2,0,0]=4 269 B8R1.5 FC1=CC=CN=C1I SPC-j951 [0,1,0,0,0,1|2,0,0]=4 270 B8R1.5 NC1=C(Br)C=CC=N1 SPC-s923 [0,1,0,0,0,1|2,0,0]=4 271 B8R1.5 NC1=C(Br)C=NC=C1 SPC-s924 [0,1,0,0,0,1|2,0,0]=4 272 B8R1.5 NC1=C(F)C=NC=C1 SPC-p381 [0,1,0,0,0,1|2,0,0]=4 273 B8R1.5 NC1=C(I)C=CC=N1 SPC-p395 [0,1,0,0,0,1|2,0,0]=4 274 B8R1.5 NC1=C(I)C=NC=C1 SPC-r427 [0,1,0,0,0,1|2,0,0]=4 275 B8R1.5 NC1=C(N)C=NC=C1 SPC-g158 [0,1,0,0,0,1|2,0,0]=4 276 B8R1.5 NC1=CC=CN=C1O SPC-k107 [0,1,0,0,0,1|2,0,0]=4 277 B8R1.5 NC1=CC=NN=C1Cl SPC-v468 [0,1,0,0,0,1|1,0,1]=4 278 B8R1.5 O=C1NC=NC=C1Br SPC-j361 [0,1,0,0,0,1|1,0,0]=3 279 B8R1.5 O=C1NN=CC=C1Cl SPC-j784 [0,1,0,0,0,1|1,0,0]=3 280 B8R1.5 OC1=CC=CN=C1Br SPC-p191 [0,1,0,0,0,1|2,0,0]=4 281 B8R1.5 OC1=CC=CN=C1F SPC-r423 [0,1,0,0,0,1|2,0,0]=4 282 B8R1.1 CC1=CN=C(CN)O1 SPC-s089 [0,2,0,0,0,0|2,0,0]=4 283 B8R1.1 CC1=CNC(CO)=N1 SPC-q878 [0,2,0,0,0,0|2,0,0]=4 284 B8R1.1 CCC1=NNC(N)=C1 SPC-m122 [0,2,0,0,0,0|2,0,0]=4 285 B8R1.1 CCN1C=C(N)C=N1 SPC-j655 [0,2,0,0,0,0|1,0,0]=3 286 B8R1.1 CN1C=C(C#N)C=N1 SPC-g794 [0,2,0,0,0,0|0,0,1]=3 287 B8R1.1 CN1C=C(C=O)C=N1 SPC-g577 [0,2,0,0,0,0|0,0,1]=3 288 B8R1.1 CN1C=C(CBr)C=N1 SPC-i882 [0,2,0,0,0,0|0,0,0]=2 289 B8R1.1 CN1C=C(CN)C=N1 SPC-j411 [0,2,0,0,0,0|0,0,0]=2 290 B8R1.1 CN1C=C(CN)C=N1 SPC-m754 [0,2,0,0,0,0|0,0,0]=2 291 B8R1.1 CN1C=C(CO)C=N1 SPC-j412 [0,2,0,0,0,0|0,0,0]=2 292 B8R1.1 CN1C=CC(CCl)=N1 SPC-p273 [0,2,0,0,0,0|2,0,0]=4 293 B8R1.1 CN1C=CC(CN)=N1 SPC-v313 [0,2,0,0,0,0|2,0,0]=4 294 B8R1.1 CN1C=CC(CO)=N1 SPC-n647 [0,2,0,0,0,0|2,0,0]=4 295 B8R1.1 CN1C=NC(C#N)=C1 SPC-k810 [0,2,0,0,0,0|2,0,0]=4 296 B8R1.1 CN1C=NC(C=O)=C1 SPC-h471 [0,2,0,0,0,0|2,0,0]=4 297 B8R1.1 CN1C=NC(CN)=C1 SPC-k730 [0,2,0,0,0,0|2,0,0]=4 298 B8R1.1 CN1C=NC(CN)=C1 SPC-n642 [0,2,0,0,0,0|2,0,0]=4 299 B8R1.1 CN1C=NC(CN)=C1 SPC-n643 [0,2,0,0,0,0|2,0,0]=4 300 B8R1.1 COC1=CC(N)=NN1 SPC-h491 [0,2,0,0,0,0|2,0,0]=4 301 B8R1.1 NC1=CC(CO)=NN1 SPC-n731 [0,2,0,0,0,0|2,0,0]=4 302 B8R1.1 NCC1=CSC(Br)=C1 SPC-s699 [0,2,0,0,0,0|2,0,0]=4 303 B8R1.1 NCC1=CSC(Cl)=C1 SPC-j590 [0,2,0,0,0,0|2,0,0]=4 304 B8R1.1 OCC1=NNC(Br)=C1 SPC-s698 [0,2,0,0,0,0|2,0,0]=4 305 B8R1.7 CC(=O)C1=CNN=C1 SPC-h422 [0,2,0,0,0,0|0,0,0]=2 306 B8R1.7 CC(=O)C1=CSC=C1 SPC-g143 [0,2,0,0,0,0|2,0,0]=4 307 B8R1.7 FC(F)C1=CNN=C1 SPC-v062 [0,2,0,0,0,0|0,0,0]=2 308 B8R1.7 O=C(O)C1=CNN=C1 SPC-g179 [0,2,0,0,0,0|0,0,1]=3 309 B8R1.7 O=C(O)C1=CSN=C1 SPC-r366 [0,2,0,0,0,0|1,0,1]=4 310 B8R1.7 O=[N+]([O-])C1=CNN=C1 SPC-k192 [0,2,0,0,0,0|1,0,0]=3 311 B8R1.7 OB(O)C1=CNN=C1 SPC-i993 [0,2,0,0,0,0|1,0,0]=3 312 B8R1.8 COCC1=CNN=C1 SPC-v186 [0,2,0,0,0,0|0,0,0]=2 313 B8R1.8 N#CCC1=CN=CN1 SPC-g884 [0,2,0,0,0,0|2,0,0]=4 314 B8R1.8 NCCC1=CSC=C1 SPC-m942 [0,2,0,0,0,0|2,0,0]=4 315 B8R1.8 OCCC1=CN=CN1 SPC-j620 [0,2,0,0,0,0|2,0,0]=4 316 B8R1.11 BrCC1=C(Br)SC=C1 SPC-j368 [0,2,0,0,0,0|2,0,0]=4 317 B8R1.11 CC1=C(CN)NN=C1 SPC-u271 [0,2,0,0,0,0|0,0,0]=2 318 B8R1.11 CC1=CSC=C1C=O SPC-p593 [0,2,0,0,0,0|2,0,0]=4 319 B8R1.11 CC1=NNC=C1C#N SPC-t059 [0,2,0,0,0,0|0,0,1]=3 320 B8R1.11 CC1=NNC=C1C=O SPC-t795 [0,2,0,0,0,0|0,0,1]=3 321 B8R1.11 CN1C=CN=C1C#N SPC-k122 [0,2,0,0,0,0|2,0,0]=4 322 B8R1.11 CN1C=CN=C1CN SPC-u748 [0,2,0,0,0,0|2,0,0]=4 323 B8R1.11 CN1C=NC=C1C#N SPC-k811 [0,2,0,0,0,0|2,0,0]=4 324 B8R1.11 CN1C=NC=C1CN SPC-j569 [0,2,0,0,0,0|2,0,0]=4 325 B8R1.11 CN1C=NC=C1CO SPC-k909 [0,2,0,0,0,0|2,0,0]=4 326 B8R1.11 N#CC1=CNN=C1I SPC-n063 [0,2,0,0,0,0|0,0,1]=3 327 B8R1.11 N#CC1=NNC=C1Cl SPC-k027 [0,2,0,0,0,0|1,0,0]=3 328 B8R1.18 CC1=CC(N)=NN1C SPC-v288 [0,2,0,0,0,0|2,0,0]=4 329 B8R1.18 CC1=NN(C)C(Br)=C1 SPC-h917 [0,2,0,0,0,0|2,0,0]=4 330 B8R1.18 CC1=NN(C)C(Br)=C1 SPC-p639 [0,2,0,0,0,0|2,0,0]=4 331 B8R1.18 CC1=NN(C)C(N)=C1 SPC-g524 [0,2,0,0,0,0|2,0,0]=4 332 B8R1.18 CC1=NN(C)C=C1Br SPC-r413 [0,2,0,0,0,0|1,0,0]=3 333 B8R1.18 CC1=NN(C)C=C1N SPC-h805 [0,2,0,0,0,0|1,0,0]=3 334 B8R1.18 CN1C=C(Br)C(F)=N1 SPC-s990 [0,2,0,0,0,0|1,0,0]=3 335 B8R1.18 CN1C=C(Br)C(N)=N1 SPC-t802 [0,2,0,0,0,0|1,0,0]=3 336 B8R1.18 CN1C=C(Br)N=C1Br SPC-v289 [0,2,0,0,0,0|2,0,0]=4 337 B8R1.50 CC1=C(Br)N(C)N=C1 SPC-p640 [0,2,0,0,0,0|0,0,0]=2 338 B8R1.50 CC1=NNC(Cl)=C1N SPC-p686 [0,2,0,0,0,0|1,0,0]=3 339 B8R1.50 CC1=NOC(C)=C1Br SPC-g013 [0,2,0,0,0,0|2,0,0]=4 340 B8R1.50 CN1C(=O)N=NC1=O SPC-w118 [0,2,0,0,0,0|1,0,1]=4 341 B8R1.50 CN1C(Br)=CN=C1Br SPC-s210 [0,2,0,0,0,0|2,0,0]=4 342 B8R1.50 CN1C=NC(Br)=C1Br SPC-t902 [0,2,0,0,0,0|2,0,0]=4 343 B8R1.50 CN1N=CC(Br)=C1N SPC-v355 [0,2,0,0,0,0|1,0,0]=3 344 B6R1.1 C1=CCNCC1 SPC-g659 [0,0,1,1,0,0|1,0,1]=4