0 B7R1.1 BrCC1=CC=CS1 AMY22870 [0,0,0,0,0,0|1,1,1]=3 1 B7R1.1 BrCC1=CC=NO1 AM804245 [0,0,0,0,0,0|2,0,1]=3 2 B7R1.1 BrCC1=CN=CS1 AM20090008 [0,0,0,0,0,0|2,1,1]=4 3 B7R1.1 BrCC1=CSC=C1 AM100695 [0,0,0,0,0,0|3,0,1]=4 4 B7R1.1 BrCC1=NC=CO1 AM85471 [0,0,0,0,0,0|2,0,1]=3 5 B7R1.1 BrCC1=NOC=C1 AM804339 [0,0,0,0,0,0|3,0,1]=4 6 B7R1.1 C#CC1=CC=CS1 AMY15557 [0,0,0,0,0,0|1,1,1]=3 7 B7R1.1 C#CC1=CSC=C1 AMY15559 [0,0,0,0,0,0|3,0,1]=4 8 B7R1.1 C=CC1=CC=CS1 AM84662 [0,0,0,0,0,0|1,1,0]=2 9 B7R1.1 C=CC1=NC=CN1 AMY440 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.1 C=CC1=NCCO1 AMY10793 [0,0,0,0,0,0|2,0,2]=4 11 B7R1.1 C=CC1=NNC=C1 AMY34845 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.1 C=CN1C=CN=C1 AMY23172 [0,0,0,0,0,0|4,0,0]=4 13 B7R1.1 CCC1=CC=CS1 AM20110253 [0,0,0,0,0,0|1,1,1]=3 14 B7R1.1 CCC1=NC=CN1 AM81998 [0,0,0,0,0,0|3,0,1]=4 15 B7R1.1 CCC1=NN=CO1 AM20080226 [0,0,0,0,0,0|3,0,1]=4 16 B7R1.1 CCN1C=CC=N1 AM20090357 [0,0,0,0,0,0|3,0,1]=4 17 B7R1.1 CNC1=NC=CO1 AM804633 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.1 CNC1=NC=CS1 AMY28978 [0,0,0,0,0,0|3,1,0]=4 19 B7R1.1 CNC1=NNC=C1 AM806557 [0,0,0,0,0,0|4,0,0]=4 20 B7R1.1 CNC1=NOC=C1 AM806468 [0,0,0,0,0,0|4,0,0]=4 21 B7R1.1 CNC1=NOC=C1 AM806552 [0,0,0,0,0,0|4,0,0]=4 22 B7R1.1 COC1=CC=CS1 AMY23227 [0,0,0,0,0,0|2,1,0]=3 23 B7R1.1 COC1=CSC=C1 AMY23252 [0,0,0,0,0,0|4,0,0]=4 24 B7R1.1 COC1=NNC=C1 AMY5035 [0,0,0,0,0,0|4,0,0]=4 25 B7R1.1 CSC1=CNC=N1 AMY36581 [0,0,0,0,0,0|4,0,0]=4 26 B7R1.1 ClCC1=CC=CO1 AMY26896 [0,0,0,0,0,0|1,0,1]=2 27 B7R1.1 ClCC1=CC=CS1 AM20100753 [0,0,0,0,0,0|1,1,1]=3 28 B7R1.1 ClCC1=CN=CN1 AM90206 [0,0,0,0,0,0|3,0,1]=4 29 B7R1.1 ClCC1=CN=CO1 AMY41018 [0,0,0,0,0,0|2,0,1]=3 30 B7R1.1 ClCC1=CN=CS1 AM100831 [0,0,0,0,0,0|2,1,1]=4 31 B7R1.1 ClCC1=CN=CS1 AM91849 [0,0,0,0,0,0|2,1,1]=4 32 B7R1.1 ClCC1=CSC=C1 AM100610 [0,0,0,0,0,0|3,0,1]=4 33 B7R1.1 ClCC1=CSC=N1 AMY13412 [0,0,0,0,0,0|3,0,1]=4 34 B7R1.1 ClCC1=NC=CO1 AM20090081 [0,0,0,0,0,0|2,0,1]=3 35 B7R1.1 ClCC1=NNC=C1 AMY9070 [0,0,0,0,0,0|3,0,1]=4 36 B7R1.1 N#CC1=CC=CN1 AM90100 [0,0,0,0,0,0|2,0,1]=3 37 B7R1.1 N#CC1=CC=CO1 AMY202100107 [0,0,0,0,0,0|1,0,1]=2 38 B7R1.1 N#CC1=CC=CS1 AM20070640 [0,0,0,0,0,0|1,1,1]=3 39 B7R1.1 N#CC1=CN=CN1 AM20100401 [0,0,0,0,0,0|3,0,1]=4 40 B7R1.1 N#CC1=COC=C1 AM20090407 [0,0,0,0,0,0|3,0,1]=4 41 B7R1.1 N#CC1=COC=N1 AMY29122 [0,0,0,0,0,0|3,0,1]=4 42 B7R1.1 N#CC1=CSC=C1 AM20080462 [0,0,0,0,0,0|3,0,1]=4 43 B7R1.1 N#CC1=CSC=N1 AMY1638 [0,0,0,0,0,0|3,0,1]=4 44 B7R1.1 N#CC1=NC=CO1 AM85873 [0,0,0,0,0,0|2,0,1]=3 45 B7R1.1 N#CC1=NC=CS1 AM85588 [0,0,0,0,0,0|2,1,1]=4 46 B7R1.1 N#CC1=NNC=C1 AM20090586 [0,0,0,0,0,0|3,0,1]=4 47 B7R1.1 N#CC1=NOC=C1 AMY3701 [0,0,0,0,0,0|3,0,1]=4 48 B7R1.1 NCC1=CC=CN1 AMY19157 [0,0,0,0,0,0|2,0,1]=3 49 B7R1.1 NCC1=CC=CS1 AM803624 [0,0,0,0,0,0|1,1,1]=3 50 B7R1.1 NCC1=CC=NO1 AM20120499 [0,0,0,0,0,0|2,0,1]=3 51 B7R1.1 NCC1=CN=CO1 AM20110214 [0,0,0,0,0,0|2,0,1]=3 52 B7R1.1 NCC1=CN=CS1 AM20080445 [0,0,0,0,0,0|2,1,1]=4 53 B7R1.1 NCC1=CN=CS1 AM91850 [0,0,0,0,0,0|2,1,1]=4 54 B7R1.1 NCC1=CN=CS1 AMY34314 [0,0,0,0,0,0|2,1,1]=4 55 B7R1.1 NCC1=CNC=N1 AMY23030 [0,0,0,0,0,0|3,0,1]=4 56 B7R1.1 NCC1=CNC=N1 AMY7828 [0,0,0,0,0,0|3,0,1]=4 57 B7R1.1 NCC1=CSC=N1 AM806141 [0,0,0,0,0,0|3,0,1]=4 58 B7R1.1 NCC1=NC=CN1 AM20090227 [0,0,0,0,0,0|3,0,1]=4 59 B7R1.1 NCC1=NC=CS1 AM20100366 [0,0,0,0,0,0|2,1,1]=4 60 B7R1.1 NCC1=NC=CS1 AMY16275 [0,0,0,0,0,0|2,1,1]=4 61 B7R1.1 NCC1=NNC=C1 AM20090607 [0,0,0,0,0,0|3,0,1]=4 62 B7R1.1 NCC1=NNC=C1 AMY36478 [0,0,0,0,0,0|3,0,1]=4 63 B7R1.1 NCC1=NOC=C1 AM20080222 [0,0,0,0,0,0|3,0,1]=4 64 B7R1.1 NNC1=NC=CS1 AMY4938 [0,0,0,0,0,0|3,1,0]=4 65 B7R1.1 O=CC1=CC=CN1 AM20070639 [0,0,0,0,0,0|1,0,0]=1 66 B7R1.1 O=CC1=CC=CO1 AM81812 [0,0,0,0,0,0|0,0,0]=0 67 B7R1.1 O=CC1=CC=CS1 AM20120394 [0,0,0,0,0,0|0,1,0]=1 68 B7R1.1 O=CC1=CC=NN1 AMY11891 [0,0,0,0,0,0|2,0,0]=2 69 B7R1.1 O=CC1=CC=NO1 AMY41963 [0,0,0,0,0,0|1,0,0]=1 70 B7R1.1 O=CC1=CC=NS1 AMY42117 [0,0,0,0,0,0|1,1,0]=2 71 B7R1.1 O=CC1=CCC=C1 AMY14685 [0,0,0,0,0,0|1,0,1]=2 72 B7R1.1 O=CC1=CCCC1 AMY30885 [0,0,0,0,0,0|1,0,2]=3 73 B7R1.1 O=CC1=CN=CO1 AM20080128 [0,0,0,0,0,0|1,0,0]=1 74 B7R1.1 O=CC1=CN=CS1 AM20070641 [0,0,0,0,0,0|1,1,0]=2 75 B7R1.1 O=CC1=CNC=C1 AM20100673 [0,0,0,0,0,0|2,0,0]=2 76 B7R1.1 O=CC1=CNC=N1 AM20090419 [0,0,0,0,0,0|2,0,0]=2 77 B7R1.1 O=CC1=CNN=C1 AM20090558 [0,0,0,0,0,0|3,0,0]=3 78 B7R1.1 O=CC1=CNN=C1 AMY37245 [0,0,0,0,0,0|3,0,0]=3 79 B7R1.1 O=CC1=COC=C1 AM85794 [0,0,0,0,0,0|2,0,0]=2 80 B7R1.1 O=CC1=COC=N1 AM20080127 [0,0,0,0,0,0|2,0,0]=2 81 B7R1.1 O=CC1=CSC=C1 AM20100214 [0,0,0,0,0,0|2,0,0]=2 82 B7R1.1 O=CC1=CSC=N1 AM20090515 [0,0,0,0,0,0|2,0,0]=2 83 B7R1.1 O=CC1=NC=CN1 AM20070660 [0,0,0,0,0,0|2,0,0]=2 84 B7R1.1 O=CC1=NC=CO1 AM20100592 [0,0,0,0,0,0|1,0,0]=1 85 B7R1.1 O=CC1=NC=CS1 AM20070674 [0,0,0,0,0,0|1,1,0]=2 86 B7R1.1 O=CC1=NNC=C1 AM20100032 [0,0,0,0,0,0|2,0,0]=2 87 B7R1.1 O=CC1=NOC=C1 AM804505 [0,0,0,0,0,0|2,0,0]=2 88 B7R1.1 O=C[C@@H]1CCCO1 AM85907 [0,0,0,0,0,0|0,0,4]=4 89 B7R1.1 O=S=C1NC=CO1 AMY37038 [0,0,0,0,0,0|2,0,0]=2 90 B7R1.1 OCC1=CC=CN1 AMY19087 [0,0,0,0,0,0|1,0,2]=3 91 B7R1.1 OCC1=CC=CO1 AM81811 [0,0,0,0,0,0|0,0,2]=2 92 B7R1.1 OCC1=CC=CS1 AM804174 [0,0,0,0,0,0|0,1,2]=3 93 B7R1.1 OCC1=CC=NO1 AM20120507 [0,0,0,0,0,0|1,0,2]=3 94 B7R1.1 OCC1=CN=CN1 AM804377 [0,0,0,0,0,0|2,0,2]=4 95 B7R1.1 OCC1=CN=CO1 AM86088 [0,0,0,0,0,0|1,0,2]=3 96 B7R1.1 OCC1=CN=CS1 AM20100025 [0,0,0,0,0,0|1,1,2]=4 97 B7R1.1 OCC1=CNC=N1 AM20090479 [0,0,0,0,0,0|2,0,2]=4 98 B7R1.1 OCC1=COC=C1 AM85772 [0,0,0,0,0,0|2,0,2]=4 99 B7R1.1 OCC1=COC=N1 AM20080403 [0,0,0,0,0,0|2,0,2]=4 100 B7R1.1 OCC1=CSC=C1 AMY17815 [0,0,0,0,0,0|2,0,2]=4 101 B7R1.1 OCC1=CSC=N1 AM20100663 [0,0,0,0,0,0|2,0,2]=4 102 B7R1.1 OCC1=NC=CN1 AM807005 [0,0,0,0,0,0|2,0,2]=4 103 B7R1.1 OCC1=NC=CO1 AM20080218 [0,0,0,0,0,0|1,0,2]=3 104 B7R1.1 OCC1=NC=CS1 AM803222 [0,0,0,0,0,0|1,1,2]=4 105 B7R1.1 OCC1=NNC=C1 AM20090254 [0,0,0,0,0,0|2,0,2]=4 106 B7R1.1 OCC1=NNC=C1 AMY29121 [0,0,0,0,0,0|2,0,2]=4 107 B7R1.1 OCC1=NOC=C1 AMY37652 [0,0,0,0,0,0|2,0,2]=4 108 B6R1.2 BrC1=CC=CO1 AMY11096 [1,0,0,0,0,0|1,0,0]=2 109 B6R1.2 BrC1=CC=CS1 AMY21853 [1,0,0,0,0,0|1,1,0]=3 110 B6R1.2 BrC1=CC=NO1 AMY42513 [1,0,0,0,0,0|2,0,0]=3 111 B6R1.2 BrC1=CN=CS1 AM20090420 [1,0,0,0,0,0|2,1,0]=4 112 B6R1.2 BrC1=CNC=C1 AMY19187 [1,0,0,0,0,0|3,0,0]=4 113 B6R1.2 BrC1=CNC=N1 AM20090241 [1,0,0,0,0,0|3,0,0]=4 114 B6R1.2 BrC1=COC=C1 AM81635 [1,0,0,0,0,0|3,0,0]=4 115 B6R1.2 BrC1=CSC=C1 AM81213 [1,0,0,0,0,0|3,0,0]=4 116 B6R1.2 BrC1=CSC=N1 AM20090525 [1,0,0,0,0,0|3,0,0]=4 117 B6R1.2 BrC1=NC=CN1 AM20080475 [1,0,0,0,0,0|3,0,0]=4 118 B6R1.2 BrC1=NC=CS1 AM803661 [1,0,0,0,0,0|2,1,0]=4 119 B6R1.2 BrC1=NNC=C1 AM20080342 [1,0,0,0,0,0|3,0,0]=4 120 B6R1.2 BrC1=NOC=C1 AM802930 [1,0,0,0,0,0|3,0,0]=4 121 B6R1.2 CC1=CC=CN1 AMY18997 [1,0,0,0,0,0|1,0,1]=3 122 B6R1.2 CC1=CC=CO1 AMY11051 [1,0,0,0,0,0|0,0,1]=2 123 B6R1.2 CC1=CC=CS1 AMY23234 [1,0,0,0,0,0|0,1,1]=3 124 B6R1.2 CC1=CC=NN1 AM20120265 [1,0,0,0,0,0|2,0,1]=4 125 B6R1.2 CC1=CC=NO1 AM20100414 [1,0,0,0,0,0|1,0,1]=3 126 B6R1.2 CC1=CN=C[Tb]1 AMY33347 [1,0,0,0,0,0|2,0,1]=4 127 B6R1.2 CC1=CNC=C1 AMY14173 [1,0,0,0,0,0|2,0,1]=4 128 B6R1.2 CC1=CNC=N1 AMY23279 [1,0,0,0,0,0|2,0,1]=4 129 B6R1.2 CC1=COC=N1 AMY32123 [1,0,0,0,0,0|2,0,1]=4 130 B6R1.2 CC1=CSC=C1 AMY40151 [1,0,0,0,0,0|2,0,1]=4 131 B6R1.2 CC1=CSC=N1 AM20100646 [1,0,0,0,0,0|2,0,1]=4 132 B6R1.2 CC1=NC=CN1 AM20100647 [1,0,0,0,0,0|2,0,1]=4 133 B6R1.2 CC1=NC=CO1 AMY24088 [1,0,0,0,0,0|1,0,1]=3 134 B6R1.2 CC1=NC=CS1 AM20090566 [1,0,0,0,0,0|1,1,1]=4 135 B6R1.2 CC1=NN=CO1 AM20090539 [1,0,0,0,0,0|2,0,1]=4 136 B6R1.2 CC1=NNC=C1 AM62623 [1,0,0,0,0,0|2,0,1]=4 137 B6R1.2 CN1C=CC=C1 AM10659 [1,0,0,0,0,0|2,0,1]=4 138 B6R1.2 CN1C=CC=N1 AM20120336 [1,0,0,0,0,0|2,0,1]=4 139 B6R1.2 ClC1=CC=CS1 AM82003 [1,0,0,0,0,0|1,1,0]=3 140 B6R1.2 ClC1=CC=NN1 AMY19315 [1,0,0,0,0,0|3,0,0]=4 141 B6R1.2 ClC1=CSC=C1 AMY23250 [1,0,0,0,0,0|3,0,0]=4 142 B6R1.2 ClC1=CSC=N1 AMY1636 [1,0,0,0,0,0|3,0,0]=4 143 B6R1.2 ClC1=NC=CN1 AM803289 [1,0,0,0,0,0|3,0,0]=4 144 B6R1.2 ClC1=NC=CS1 AM803660 [1,0,0,0,0,0|2,1,0]=4 145 B6R1.2 ClC1=NNC=C1 AMY11915 [1,0,0,0,0,0|3,0,0]=4 146 B6R1.2 FC1=CC=CS1 AM85431 [1,0,0,0,0,0|1,1,0]=3 147 B6R1.2 FC1=CNC=C1 AMY14699 [1,0,0,0,0,0|3,0,0]=4 148 B6R1.2 FC1=NNC=C1 AMY34850 [1,0,0,0,0,0|3,0,0]=4 149 B6R1.2 IC1=CC=CS1 AM86883 [1,0,0,0,0,0|1,1,0]=3 150 B6R1.2 IC1=CC=NN1 AM20070657 [1,0,0,0,0,0|3,0,0]=4 151 B6R1.2 IC1=CNC=N1 AM20090545 [1,0,0,0,0,0|3,0,0]=4 152 B6R1.2 IC1=CSC=C1 AM20070697 [1,0,0,0,0,0|3,0,0]=4 153 B6R1.2 IC1=NC=CN1 AM20090422 [1,0,0,0,0,0|3,0,0]=4 154 B6R1.2 IC1=NC=CO1 AMY33608 [1,0,0,0,0,0|2,0,0]=3 155 B6R1.2 IC1=NC=CS1 AMY27328 [1,0,0,0,0,0|2,1,0]=4 156 B6R1.2 IC1=NNC=C1 AM803927 [1,0,0,0,0,0|3,0,0]=4 157 B6R1.2 NC1=CC=NN1 AMY23077 [1,0,0,0,0,0|3,0,0]=4 158 B6R1.2 NC1=CC=NO1 AM20080357 [1,0,0,0,0,0|2,0,0]=3 159 B6R1.2 NC1=CC=NS1 AMY18758 [1,0,0,0,0,0|2,1,0]=4 160 B6R1.2 NC1=CN=CS1 AM82008 [1,0,0,0,0,0|2,1,0]=4 161 B6R1.2 NC1=CNC=N1 AMY40030 [1,0,0,0,0,0|3,0,0]=4 162 B6R1.2 NC1=CSC=C1 AMY15168 [1,0,0,0,0,0|3,0,0]=4 163 B6R1.2 NC1=CSC=C1 AMY15435 [1,0,0,0,0,0|3,0,0]=4 164 B6R1.2 NC1=CSC=C1 AMY5250 [1,0,0,0,0,0|3,0,0]=4 165 B6R1.2 NC1=CSC=N1 AMY15985 [1,0,0,0,0,0|3,0,0]=4 166 B6R1.2 NC1=NC=CN1 AM20080341 [1,0,0,0,0,0|3,0,0]=4 167 B6R1.2 NC1=NC=CN1 AM82001 [1,0,0,0,0,0|3,0,0]=4 168 B6R1.2 NC1=NC=CO1 AM20100168 [1,0,0,0,0,0|2,0,0]=3 169 B6R1.2 NC1=NC=CS1 AM20120385 [1,0,0,0,0,0|2,1,0]=4 170 B6R1.2 NC1=NNC=C1 AM20090067 [1,0,0,0,0,0|3,0,0]=4 171 B6R1.2 NC1=NOC=C1 AM20090043 [1,0,0,0,0,0|3,0,0]=4 172 B6R1.2 NN1C=CC=C1 AM20100752 [1,0,0,0,0,0|3,0,0]=4 173 B6R1.2 O=C1C=CCC1 AM61702 [1,0,0,0,0,0|1,0,1]=3 174 B6R1.2 O=C1C=CCO1 AM20100212 [1,0,0,0,0,0|0,0,1]=2 175 B6R1.2 O=C1C=CNN1 AMY11929 [1,0,0,0,0,0|2,0,0]=3 176 B6R1.2 O=C1CC=NN1 AMY11924 [1,0,0,0,0,0|2,0,1]=4 177 B6R1.2 O=C1NC=CN1 AMY20044 [1,0,0,0,0,0|2,0,0]=3 178 B6R1.2 O=C1NCCO1 AMY39498 [1,0,0,0,0,0|1,0,2]=4 179 B6R1.2 O=C1OC=CO1 AMY10397 [1,0,0,0,0,0|1,0,0]=2 180 B6R1.2 OC1=NNC=C1 AMY4993 [1,0,0,0,0,0|2,0,1]=4 181 B6R1.2 OC1=NOC=C1 AMY12303 [1,0,0,0,0,0|2,0,1]=4 182 B6R1.2 ON1C=CC=N1 AMY34612 [1,0,0,0,0,0|2,0,1]=4 183 B6R1.2 SC1=CC=CS1 AMY33408 [1,0,0,0,0,0|0,2,0]=3 184 B6R1.2 SC1=CSC=C1 AMY10985 [1,0,0,0,0,0|2,1,0]=4 185 B6R1.2 SC1=NC=CS1 AM10703 [1,0,0,0,0,0|1,2,0]=4 186 B8R1.1 CC1=CC(C=O)=NO1 AM804146 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.1 CC1=CC=C(C#N)N1 AMY19095 [0,1,0,0,0,0|2,0,1]=4 188 B8R1.1 CC1=CC=C(C#N)S1 AMY4814 [0,1,0,0,0,0|1,1,1]=4 189 B8R1.1 CC1=CC=C(C=O)N1 AM803022 [0,1,0,0,0,0|1,0,0]=2 190 B8R1.1 CC1=CC=C(C=O)O1 AMY23296 [0,1,0,0,0,0|0,0,0]=1 191 B8R1.1 CC1=CC=C(C=O)S1 AM803182 [0,1,0,0,0,0|0,1,0]=2 192 B8R1.1 CC1=CC=C(CN)S1 AM802866 [0,1,0,0,0,0|1,1,1]=4 193 B8R1.1 CC1=CC=C(CN)S1 AMY4599 [0,1,0,0,0,0|1,1,1]=4 194 B8R1.1 CC1=CC=C(CO)O1 AMY41923 [0,1,0,0,0,0|0,0,2]=3 195 B8R1.1 CC1=CC=C(CO)S1 AM804180 [0,1,0,0,0,0|0,1,2]=4 196 B8R1.1 CC1=CN=C(C=O)N1 AM20080647 [0,1,0,0,0,0|2,0,0]=3 197 B8R1.1 CC1=CN=C(CN)O1 AMY35786 [0,1,0,0,0,0|2,0,1]=4 198 B8R1.1 CC1=CN=C(CN)O1 AMY35797 [0,1,0,0,0,0|2,0,1]=4 199 B8R1.1 CC1=CNC(C=O)=C1 AMY17862 [0,1,0,0,0,0|1,0,0]=2 200 B8R1.1 CC1=COC(CN)=N1 AM806396 [0,1,0,0,0,0|2,0,1]=4 201 B8R1.1 CC1=CSC(C=O)=C1 AM804119 [0,1,0,0,0,0|0,1,0]=2 202 B8R1.1 CC1=CSC(C=O)=N1 AM803186 [0,1,0,0,0,0|1,1,0]=3 203 B8R1.1 CC1=CSC(CN)=C1 AM802868 [0,1,0,0,0,0|1,1,1]=4 204 B8R1.1 CC1=CSC(CO)=C1 AM804307 [0,1,0,0,0,0|0,1,2]=4 205 B8R1.1 CC1=NC(C=O)=CO1 AM20080084 [0,1,0,0,0,0|2,0,0]=3 206 B8R1.1 CC1=NC(C=O)=CS1 AM20090176 [0,1,0,0,0,0|2,0,0]=3 207 B8R1.1 CC1=NC=C(C=O)N1 AM803754 [0,1,0,0,0,0|2,0,0]=3 208 B8R1.1 CC1=NC=C(C=O)S1 AMY18110 [0,1,0,0,0,0|1,1,0]=3 209 B8R1.1 CC1=NC=C(CO)O1 AMY202003195 [0,1,0,0,0,0|1,0,2]=4 210 B8R1.1 CC1=NN=C(C=O)O1 AMY202100035 [0,1,0,0,0,0|2,0,0]=3 211 B8R1.1 CC1=NNC(C=O)=C1 AM803701 [0,1,0,0,0,0|2,0,0]=3 212 B8R1.1 CC1=NOC(CBr)=C1 AMY23827 [0,1,0,0,0,0|2,0,1]=4 213 B8R1.1 CC1=NOC(CN)=C1 AMY18673 [0,1,0,0,0,0|2,0,1]=4 214 B8R1.1 CCC1=CC(N)=NO1 AM806538 [0,1,0,0,0,0|2,0,1]=4 215 B8R1.1 CN1C=C(C=O)C=N1 AM20090285 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.1 CN1C=CC(C=O)=N1 AM20090340 [0,1,0,0,0,0|2,0,0]=3 217 B8R1.1 CN1C=NC(C=O)=C1 AMY22924 [0,1,0,0,0,0|2,0,0]=3 218 B8R1.1 COC1=CC(N)=NO1 AM20090468 [0,1,0,0,0,0|3,0,0]=4 219 B8R1.1 ClCC1=CC=C(Cl)S1 AM808041 [0,1,0,0,0,0|1,1,1]=4 220 B8R1.1 N#CC1=CC(Br)=CS1 AMY4783 [0,1,0,0,0,0|1,1,1]=4 221 B8R1.1 N#CC1=CC=C(Br)O1 AMY27094 [0,1,0,0,0,0|1,0,1]=3 222 B8R1.1 N#CC1=CC=C(Br)S1 AM20090196 [0,1,0,0,0,0|1,1,1]=4 223 B8R1.1 NC1=NC=C(C=O)S1 AM20070642 [0,1,0,0,0,0|1,1,0]=3 224 B8R1.1 NCC1=CC(Br)=CS1 AMY27187 [0,1,0,0,0,0|1,1,1]=4 225 B8R1.1 NCC1=CC(Br)=CS1 AMY27763 [0,1,0,0,0,0|1,1,1]=4 226 B8R1.1 NCC1=CC=C(Br)S1 AMY4598 [0,1,0,0,0,0|1,1,1]=4 227 B8R1.1 NCC1=CC=C(Cl)S1 AMY4935 [0,1,0,0,0,0|1,1,1]=4 228 B8R1.1 O=C1C=C[C@@H](CO)O1 AMY42490 [0,1,0,0,0,0|0,0,3]=4 229 B8R1.1 O=CC1=CC(Br)=CN1 AMY19096 [0,1,0,0,0,0|1,0,0]=2 230 B8R1.1 O=CC1=CC(Br)=CS1 AMY23272 [0,1,0,0,0,0|0,1,0]=2 231 B8R1.1 O=CC1=CC(I)=CN1 AMY19170 [0,1,0,0,0,0|1,0,0]=2 232 B8R1.1 O=CC1=CC=C(Br)N1 AMY29098 [0,1,0,0,0,0|1,0,0]=2 233 B8R1.1 O=CC1=CC=C(Br)O1 AM20090109 [0,1,0,0,0,0|0,0,0]=1 234 B8R1.1 O=CC1=CC=C(Br)S1 AM20100185 [0,1,0,0,0,0|0,1,0]=2 235 B8R1.1 O=CC1=CC=C(Cl)S1 AMY23290 [0,1,0,0,0,0|0,1,0]=2 236 B8R1.1 O=CC1=CN=C(Br)S1 AM20100183 [0,1,0,0,0,0|1,1,0]=3 237 B8R1.1 O=CC1=CN=C(Cl)S1 AM804606 [0,1,0,0,0,0|1,1,0]=3 238 B8R1.1 O=CC1=CNC(Br)=C1 AMY19188 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.1 O=CC1=CSC(Br)=C1 AMY35040 [0,1,0,0,0,0|2,0,0]=3 240 B8R1.1 O=CC1=CSC(Br)=N1 AM20100278 [0,1,0,0,0,0|2,0,0]=3 241 B8R1.1 O=CC1=NC(Br)=CS1 AM84573 [0,1,0,0,0,0|1,1,0]=3 242 B8R1.1 O=CC1=NC=C(Br)S1 AMY33908 [0,1,0,0,0,0|1,1,0]=3 243 B8R1.1 O=CC1=NC=C(Cl)S1 AM804099 [0,1,0,0,0,0|1,1,0]=3 244 B8R1.1 O=CC1=NNC(Br)=C1 AMY11957 [0,1,0,0,0,0|2,0,0]=3 245 B8R1.1 OCC1=CC(Br)=CS1 AMY4597 [0,1,0,0,0,0|0,1,2]=4 246 B8R1.1 OCC1=CC(Br)=NO1 AM20090315 [0,1,0,0,0,0|1,0,2]=4 247 B8R1.1 OCC1=CC=C(F)S1 AMY23548 [0,1,0,0,0,0|0,1,2]=4 248 B8R1.1 OCC1=NC=C(Br)O1 AMY27833 [0,1,0,0,0,0|1,0,2]=4 249 B8R1.7 CC(=O)C1=CC=CN1 AM90575 [0,1,0,0,0,0|1,0,0]=2 250 B8R1.7 CC(=O)C1=CC=CO1 AM91073 [0,1,0,0,0,0|0,0,0]=1 251 B8R1.7 CC(=O)C1=CC=CS1 AM82005 [0,1,0,0,0,0|0,1,0]=2 252 B8R1.7 CC(=O)C1=CCC=C1 AMY2881 [0,1,0,0,0,0|1,0,1]=3 253 B8R1.7 CC(=O)C1=CN=CS1 AM20120324 [0,1,0,0,0,0|1,1,0]=3 254 B8R1.7 CC(=O)C1=CNC=C1 AM20080688 [0,1,0,0,0,0|2,0,0]=3 255 B8R1.7 CC(=O)C1=CNC=N1 AM20100516 [0,1,0,0,0,0|2,0,0]=3 256 B8R1.7 CC(=O)C1=CNN=C1 AMY34508 [0,1,0,0,0,0|3,0,0]=4 257 B8R1.7 CC(=O)C1=CSC=C1 AM84424 [0,1,0,0,0,0|2,0,0]=3 258 B8R1.7 CC(=O)C1=CSC=N1 AM20100015 [0,1,0,0,0,0|2,0,0]=3 259 B8R1.7 CC(=O)C1=NC=CN1 AM806885 [0,1,0,0,0,0|2,0,0]=3 260 B8R1.7 CC(=O)C1=NC=CO1 AM85910 [0,1,0,0,0,0|1,0,0]=2 261 B8R1.7 CC(=O)C1=NC=CS1 AM20090269 [0,1,0,0,0,0|1,1,0]=3 262 B8R1.7 CC(=O)C1=NNC=C1 AM803485 [0,1,0,0,0,0|2,0,0]=3 263 B8R1.7 CC(=O)N1C=CN=C1 AM20090278 [0,1,0,0,0,0|3,0,0]=4 264 B8R1.7 CC(C)C1=CC=CO1 AMY39189 [0,1,0,0,0,0|1,0,1]=3 265 B8R1.7 C[C@H](Cl)C1=CC=CN1 AM91548 [0,1,0,0,0,0|2,0,1]=4 266 B8R1.7 C[C@H](Cl)C1=CC=CO1 AM100959 [0,1,0,0,0,0|1,0,1]=3 267 B8R1.7 C[C@H](Cl)C1=CC=CS1 AM100622 [0,1,0,0,0,0|1,1,1]=4 268 B8R1.7 C[C@H](N)C1=CC=CS1 AM804160 [0,1,0,0,0,0|1,1,1]=4 269 B8R1.7 C[C@H](O)C1=CC=CN1 AM100960 [0,1,0,0,0,0|1,0,2]=4 270 B8R1.7 C[C@H](O)C1=CC=CO1 AM100808 [0,1,0,0,0,0|0,0,2]=3 271 B8R1.7 C[C@H](O)C1=CC=CS1 AM804356 [0,1,0,0,0,0|0,1,2]=4 272 B8R1.7 N=C(N)C1=CC=CN1 AMY19161 [0,1,0,0,0,0|2,0,0]=3 273 B8R1.7 N=C(N)C1=CC=CS1 AMY24706 [0,1,0,0,0,0|1,1,0]=3 274 B8R1.7 N=C(N)C1=NC=CS1 AM9956 [0,1,0,0,0,0|2,1,0]=4 275 B8R1.7 N=C(N)N1C=CC=N1 AM20100072 [0,1,0,0,0,0|3,0,0]=4 276 B8R1.7 NC(=O)C1=CC=CN1 AMY29101 [0,1,0,0,0,0|1,0,0]=2 277 B8R1.7 NC(=O)C1=CC=CO1 AMY19477 [0,1,0,0,0,0|0,0,0]=1 278 B8R1.7 NC(=O)C1=CC=NO1 AM85950 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.7 NC(=O)C1=CNC=N1 AMY24018 [0,1,0,0,0,0|2,0,0]=3 280 B8R1.7 NC(=O)C1=CNN=C1 AMY12310 [0,1,0,0,0,0|3,0,0]=4 281 B8R1.7 NC(=O)C1=CSC=N1 AM803773 [0,1,0,0,0,0|2,0,0]=3 282 B8R1.7 NC(=O)C1=NC=CS1 AMY31380 [0,1,0,0,0,0|1,1,0]=3 283 B8R1.7 NC(=O)C1=NC=NN1 AMY38327 [0,1,0,0,0,0|3,0,0]=4 284 B8R1.7 NC(=O)C1=NNC=C1 AM20090500 [0,1,0,0,0,0|2,0,0]=3 285 B8R1.7 NC(=S)C1=COC=N1 AMY32458 [0,1,0,0,0,0|2,1,0]=4 286 B8R1.7 O=C(Cl)C1=CSC=C1 AMY28736 [0,1,0,0,0,0|2,0,0]=3 287 B8R1.7 O=C(Cl)N1C=CC=N1 AM806478 [0,1,0,0,0,0|2,0,0]=3 288 B8R1.7 O=C(O)C1=CC=CN1 AM20100569 [0,1,0,0,0,0|1,0,0]=2 289 B8R1.7 O=C(O)C1=CC=CS1 AM20100294 [0,1,0,0,0,0|0,1,0]=2 290 B8R1.7 O=C(O)C1=CC=NN1 AM804418 [0,1,0,0,0,0|2,0,0]=3 291 B8R1.7 O=C(O)C1=CC=NO1 AM20090179 [0,1,0,0,0,0|1,0,0]=2 292 B8R1.7 O=C(O)C1=CC=NS1 AMY23598 [0,1,0,0,0,0|1,1,0]=3 293 B8R1.7 O=C(O)C1=CCCC1 AM20080408 [0,1,0,0,0,0|1,0,2]=4 294 B8R1.7 O=C(O)C1=CCNC1 AMY32011 [0,1,0,0,0,0|2,0,1]=4 295 B8R1.7 O=C(O)C1=CN=CO1 AM10000 [0,1,0,0,0,0|1,0,0]=2 296 B8R1.7 O=C(O)C1=CN=CS1 AM20080343 [0,1,0,0,0,0|1,1,0]=3 297 B8R1.7 O=C(O)C1=CNC=C1 AM20120340 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.7 O=C(O)C1=CNC=N1 AM20080027 [0,1,0,0,0,0|2,0,0]=3 299 B8R1.7 O=C(O)C1=CNN=C1 AM20100007 [0,1,0,0,0,0|3,0,0]=4 300 B8R1.7 O=C(O)C1=COC=C1 AM20100204 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.7 O=C(O)C1=COC=N1 AM20090239 [0,1,0,0,0,0|2,0,0]=3 302 B8R1.7 O=C(O)C1=CON=C1 AM804188 [0,1,0,0,0,0|3,0,0]=4 303 B8R1.7 O=C(O)C1=CSC=C1 AM20110264 [0,1,0,0,0,0|2,0,0]=3 304 B8R1.7 O=C(O)C1=CSC=N1 AM20100047 [0,1,0,0,0,0|2,0,0]=3 305 B8R1.7 O=C(O)C1=CSN=C1 AMY23522 [0,1,0,0,0,0|3,0,0]=4 306 B8R1.7 O=C(O)C1=NC=CN1 AM20080434 [0,1,0,0,0,0|2,0,0]=3 307 B8R1.7 O=C(O)C1=NC=CO1 AM20100620 [0,1,0,0,0,0|1,0,0]=2 308 B8R1.7 O=C(O)C1=NC=CS1 AM20080317 [0,1,0,0,0,0|1,1,0]=3 309 B8R1.7 O=C(O)C1=NN=CS1 AM20100222 [0,1,0,0,0,0|2,1,0]=4 310 B8R1.7 O=C(O)C1=NNC=C1 AM20080446 [0,1,0,0,0,0|2,0,0]=3 311 B8R1.7 O=C(O)C1=NNC=N1 AMY14578 [0,1,0,0,0,0|3,0,0]=4 312 B8R1.7 O=C(O)C1=NOC=C1 AM20090462 [0,1,0,0,0,0|2,0,0]=3 313 B8R1.7 O=C(O)C1=NSC=C1 AM20100170 [0,1,0,0,0,0|2,0,0]=3 314 B8R1.7 O=C(O)C1CC=CC1 AM20100760 [0,1,0,0,0,0|1,0,2]=4 315 B8R1.7 O=C(O)N1C=CC=C1 AMY31717 [0,1,0,0,0,0|2,0,0]=3 316 B8R1.7 O=[N+]([O-])C1=CC=CN1 AMY14154 [0,1,0,0,0,0|2,0,0]=3 317 B8R1.7 O=[N+]([O-])C1=CC=CO1 AM20100483 [0,1,0,0,0,0|1,0,0]=2 318 B8R1.7 O=[N+]([O-])C1=CC=CS1 AM20100484 [0,1,0,0,0,0|1,1,0]=3 319 B8R1.7 O=[N+]([O-])C1=CC=NN1 AM20090327 [0,1,0,0,0,0|3,0,0]=4 320 B8R1.7 O=[N+]([O-])C1=CNC=C1 AMY14174 [0,1,0,0,0,0|3,0,0]=4 321 B8R1.7 O=[N+]([O-])C1=CNC=N1 AM20090417 [0,1,0,0,0,0|3,0,0]=4 322 B8R1.7 O=[N+]([O-])C1=NC=CN1 AM20100295 [0,1,0,0,0,0|3,0,0]=4 323 B8R1.7 O=[N+]([O-])N1C=CC=N1 AM20100671 [0,1,0,0,0,0|3,0,0]=4 324 B8R1.7 OB(O)C1=CC=CO1 AM20080239 [0,1,0,0,0,0|1,0,1]=3 325 B8R1.7 OB(O)C1=CC=CS1 AM804138 [0,1,0,0,0,0|1,1,1]=4 326 B8R1.8 CNCC1=CC=CS1 AM20100421 [0,1,0,0,0,0|1,1,1]=4 327 B8R1.8 N#CCC1=CC=CO1 AMY31197 [0,1,0,0,0,0|1,0,1]=3 328 B8R1.8 N#CCC1=CC=CS1 AMY23238 [0,1,0,0,0,0|1,1,1]=4 329 B8R1.8 NCCC1=CC=CN1 AMY32066 [0,1,0,0,0,0|2,0,1]=4 330 B8R1.8 NCCC1=CC=CO1 AM20080071 [0,1,0,0,0,0|1,0,1]=3 331 B8R1.8 NCCC1=CC=CS1 AM803664 [0,1,0,0,0,0|1,1,1]=4 332 B8R1.8 O=CCC1=NN=CO1 AM806539 [0,1,0,0,0,0|2,0,0]=3 333 B8R1.8 OCCC1=CC=CS1 AM82007 [0,1,0,0,0,0|0,1,2]=4 334 B8R1.8 O\N=C\C1=CC=CN1 AM806542 [0,1,0,0,0,0|1,0,1]=3 335 B8R1.11 CC1=C(C#N)SC=C1 AMY7323 [0,1,0,0,0,0|1,1,1]=4 336 B8R1.11 CC1=C(C=O)NC=C1 AMY14159 [0,1,0,0,0,0|1,0,0]=2 337 B8R1.11 CC1=C(C=O)NC=N1 AM804227 [0,1,0,0,0,0|2,0,0]=3 338 B8R1.11 CC1=C(C=O)OC=N1 AM100307 [0,1,0,0,0,0|1,0,0]=2 339 B8R1.11 CC1=C(C=O)SC=C1 AM20100422 [0,1,0,0,0,0|0,1,0]=2 340 B8R1.11 CC1=C(C=O)SC=N1 AM20100799 [0,1,0,0,0,0|1,1,0]=3 341 B8R1.11 CC1=C(CBr)OC=N1 AM101188 [0,1,0,0,0,0|2,0,1]=4 342 B8R1.11 CC1=C(CBr)SC=C1 AM100282 [0,1,0,0,0,0|1,1,1]=4 343 B8R1.11 CC1=C(CCl)OC=N1 AM100833 [0,1,0,0,0,0|2,0,1]=4 344 B8R1.11 CC1=C(CI)OC=N1 AM99832 [0,1,0,0,0,0|2,0,1]=4 345 B8R1.11 CC1=C(CN)SC=C1 AM802867 [0,1,0,0,0,0|1,1,1]=4 346 B8R1.11 CC1=C(CO)OC=N1 AM20100164 [0,1,0,0,0,0|1,0,2]=4 347 B8R1.11 CC1=C(CO)SC=C1 AM804179 [0,1,0,0,0,0|0,1,2]=4 348 B8R1.11 CC1=C(CS)OC=N1 AM99259 [0,1,0,0,0,0|1,1,1]=4 349 B8R1.11 CC1=CON=C1C=O AM806541 [0,1,0,0,0,0|2,0,0]=3 350 B8R1.11 CC1=NNC=C1C=O AM20080079 [0,1,0,0,0,0|3,0,0]=4 351 B8R1.11 CCC1=CC=CN1N AMY31540 [0,1,0,0,0,0|2,0,1]=4 352 B8R1.11 CN1C=CC=C1C#N AM803752 [0,1,0,0,0,0|2,0,1]=4 353 B8R1.11 CN1C=CC=C1C=O AMY19098 [0,1,0,0,0,0|1,0,0]=2 354 B8R1.11 CN1C=CC=C1CBr AM91469 [0,1,0,0,0,0|2,0,1]=4 355 B8R1.11 CN1C=CC=C1CCl AM91470 [0,1,0,0,0,0|2,0,1]=4 356 B8R1.11 CN1C=CC=C1CI AM98715 [0,1,0,0,0,0|2,0,1]=4 357 B8R1.11 CN1C=CC=C1CO AM100905 [0,1,0,0,0,0|1,0,2]=4 358 B8R1.11 CN1C=CC=C1CS AM101003 [0,1,0,0,0,0|1,1,1]=4 359 B8R1.11 CN1C=CN=C1C=O AM20080281 [0,1,0,0,0,0|2,0,0]=3 360 B8R1.11 CN1C=NC=C1C=O AM803828 [0,1,0,0,0,0|2,0,0]=3 361 B8R1.11 CN1N=CC=C1C=O AM20090341 [0,1,0,0,0,0|2,0,0]=3 362 B8R1.11 CN1N=CN=C1C=O AM20080649 [0,1,0,0,0,0|3,0,0]=4 363 B8R1.11 N#CC1=C(Br)C=CS1 AMY22931 [0,1,0,0,0,0|1,1,1]=4 364 B8R1.11 N#CC1=CC=CN1N AM84524 [0,1,0,0,0,0|2,0,1]=4 365 B8R1.11 N#CC1=CC=CN1N AMY39701 [0,1,0,0,0,0|2,0,1]=4 366 B8R1.11 NCC1=C(Cl)C=CS1 AMY23930 [0,1,0,0,0,0|1,1,1]=4 367 B8R1.11 O=CC1=C(Br)C=CO1 AMY20256 [0,1,0,0,0,0|0,0,0]=1 368 B8R1.11 O=CC1=C(Br)C=CS1 AM20120339 [0,1,0,0,0,0|0,1,0]=2 369 B8R1.11 O=CC1=C(Br)C=NN1 AMY12100 [0,1,0,0,0,0|2,0,0]=3 370 B8R1.11 O=CC1=C(Br)SC=C1 AMY7274 [0,1,0,0,0,0|2,0,0]=3 371 B8R1.11 O=CC1=C(Cl)C=CS1 AMY10893 [0,1,0,0,0,0|0,1,0]=2 372 B8R1.11 O=CC1=C(Cl)N=CS1 AMY20345 [0,1,0,0,0,0|1,1,0]=3 373 B8R1.11 O=CC1=CSC=C1Br AMY19052 [0,1,0,0,0,0|2,0,0]=3 374 B8R1.11 OCC1=C(Br)C=CS1 AMY34404 [0,1,0,0,0,0|0,1,2]=4 375 B6R0.1 CC\C=C(/C)C=O AMY2564 [0,0,1,0,0,0|1,0,2]=4 376 B8R1.2 BrCC1=CC=CC=C1 AMY21948 [0,0,0,0,0,1|2,0,1]=4 377 B8R1.2 BrCC1=CC=NC=C1 AM20070152 [0,0,0,0,0,1|2,0,1]=4 378 B8R1.2 BrCC1=CN=CC=C1 AM20061249 [0,0,0,0,0,1|2,0,1]=4 379 B8R1.2 BrCC1=CN=CC=C1 AM81296 [0,0,0,0,0,1|2,0,1]=4 380 B8R1.2 BrCC1=NC=CC=C1 AM20051057 [0,0,0,0,0,1|2,0,1]=4 381 B8R1.2 BrCC1=NC=CC=C1 AM81295 [0,0,0,0,0,1|2,0,1]=4 382 B8R1.2 BrCC1=NC=CN=C1 AM101005 [0,0,0,0,0,1|2,0,1]=4 383 B8R1.2 C#CC1=CC=CC=C1 AMY4006 [0,0,0,0,0,1|2,0,1]=4 384 B8R1.2 C#CC1=CC=CN=C1 AM84834 [0,0,0,0,0,1|2,0,1]=4 385 B8R1.2 C#CC1=CC=NC=C1 AM20070134 [0,0,0,0,0,1|2,0,1]=4 386 B8R1.2 C#CC1=CC=NC=C1 AMY10268 [0,0,0,0,0,1|2,0,1]=4 387 B8R1.2 C#CC1=NC=CC=C1 AM20061684 [0,0,0,0,0,1|2,0,1]=4 388 B8R1.2 C#CC1=NC=CC=N1 AMY22984 [0,0,0,0,0,1|2,0,1]=4 389 B8R1.2 C#CC1=NC=CN=C1 AMY13925 [0,0,0,0,0,1|2,0,1]=4 390 B8R1.2 C=CC1=CC=CN=C1 AM802935 [0,0,0,0,0,1|2,0,0]=3 391 B8R1.2 C=CC1=NC=CC=C1 AM20090687 [0,0,0,0,0,1|2,0,0]=3 392 B8R1.2 CCC1=CC=CC=C1 AMY11052 [0,0,0,0,0,1|2,0,1]=4 393 B8R1.2 CCC1=CC=CN=C1 AM81306 [0,0,0,0,0,1|2,0,1]=4 394 B8R1.2 CCC1=NC=CN=C1 AM20070410 [0,0,0,0,0,1|2,0,1]=4 395 B8R1.2 CNC1=CC=CC=C1 AM10675 [0,0,0,0,0,1|3,0,0]=4 396 B8R1.2 CNC1=CC=CN=C1 AM803406 [0,0,0,0,0,1|3,0,0]=4 397 B8R1.2 CNC1=CC=NC=C1 AM85482 [0,0,0,0,0,1|3,0,0]=4 398 B8R1.2 CNC1=NC=CC=C1 AMY25681 [0,0,0,0,0,1|3,0,0]=4 399 B8R1.2 CNC1=NC=CC=N1 AM101628 [0,0,0,0,0,1|3,0,0]=4 400 B8R1.2 CNC1=NC=CN=C1 AM803689 [0,0,0,0,0,1|3,0,0]=4 401 B8R1.2 CNC1=NC=NC=C1 AM803548 [0,0,0,0,0,1|3,0,0]=4 402 B8R1.2 COC1=CC=CC=C1 AMY38503 [0,0,0,0,0,1|3,0,0]=4 403 B8R1.2 COC1=CC=NC=C1 AM20061381 [0,0,0,0,0,1|3,0,0]=4 404 B8R1.2 COC1=CN=CC=C1 AM20061683 [0,0,0,0,0,1|3,0,0]=4 405 B8R1.2 COC1=NC=CC=C1 AM20050859 [0,0,0,0,0,1|3,0,0]=4 406 B8R1.2 COC1=NC=CN=C1 AM20070422 [0,0,0,0,0,1|3,0,0]=4 407 B8R1.2 CSC1=NC=CN=C1 AM84779 [0,0,0,0,0,1|3,0,0]=4 408 B8R1.2 ClCC1=CC=NC=C1 AM100416 [0,0,0,0,0,1|2,0,1]=4 409 B8R1.2 ClCC1=CC=NC=C1 AM81299 [0,0,0,0,0,1|2,0,1]=4 410 B8R1.2 ClCC1=CN=CC=C1 AM101155 [0,0,0,0,0,1|2,0,1]=4 411 B8R1.2 ClCC1=CN=CC=C1 AM81298 [0,0,0,0,0,1|2,0,1]=4 412 B8R1.2 ClCC1=NC=CC=C1 AM20070046 [0,0,0,0,0,1|2,0,1]=4 413 B8R1.2 ClCC1=NC=CC=C1 AM81297 [0,0,0,0,0,1|2,0,1]=4 414 B8R1.2 ClCC1=NC=CC=N1 AM20100337 [0,0,0,0,0,1|2,0,1]=4 415 B8R1.2 ClCC1=NC=CC=N1 AM20120357 [0,0,0,0,0,1|2,0,1]=4 416 B8R1.2 ClCC1=NC=CN=C1 AM100497 [0,0,0,0,0,1|2,0,1]=4 417 B8R1.2 ClCC1=NC=CN=C1 AM100758 [0,0,0,0,0,1|2,0,1]=4 418 B8R1.2 ClCC1=NN=CC=C1 AM20100094 [0,0,0,0,0,1|2,0,1]=4 419 B8R1.2 Cl[Se]C1=CC=CC=C1 AMY18430 [0,0,0,0,0,1|3,0,0]=4 420 B8R1.2 FCC1=CC=NC=C1 AMY16182 [0,0,0,0,0,1|2,0,1]=4 421 B8R1.2 N#CC1=CC=CC=C1 AM10697 [0,0,0,0,0,1|2,0,1]=4 422 B8R1.2 N#CC1=CC=CC=C1 AMY11856 [0,0,0,0,0,1|2,0,1]=4 423 B8R1.2 N#CC1=CC=NC=C1 AM81279 [0,0,0,0,0,1|2,0,1]=4 424 B8R1.2 N#CC1=CN=CC=C1 AM81277 [0,0,0,0,0,1|2,0,1]=4 425 B8R1.2 N#CC1=NC=CC=C1 AM81275 [0,0,0,0,0,1|2,0,1]=4 426 B8R1.2 N#CC1=NC=CC=N1 AM20080306 [0,0,0,0,0,1|2,0,1]=4 427 B8R1.2 N#CC1=NC=CN=C1 AM81383 [0,0,0,0,0,1|2,0,1]=4 428 B8R1.2 N#CC1=NC=NC=C1 AMY15801 [0,0,0,0,0,1|2,0,1]=4 429 B8R1.2 N#CC1=NN=CC=C1 AM20100324 [0,0,0,0,0,1|2,0,1]=4 430 B8R1.2 NCC1=CC=CN=C1 AM101339 [0,0,0,0,0,1|2,0,1]=4 431 B8R1.2 NCC1=CC=CN=C1 AM20061720 [0,0,0,0,0,1|2,0,1]=4 432 B8R1.2 NCC1=CC=CN=N1 AM20120345 [0,0,0,0,0,1|2,0,1]=4 433 B8R1.2 NCC1=CC=CN=N1 AMY35405 [0,0,0,0,0,1|2,0,1]=4 434 B8R1.2 NCC1=CC=NC=C1 AM101076 [0,0,0,0,0,1|2,0,1]=4 435 B8R1.2 NCC1=CC=NC=C1 AM803800 [0,0,0,0,0,1|2,0,1]=4 436 B8R1.2 NCC1=NC=CC=C1 AM101338 [0,0,0,0,0,1|2,0,1]=4 437 B8R1.2 NCC1=NC=CC=C1 AM803799 [0,0,0,0,0,1|2,0,1]=4 438 B8R1.2 NCC1=NC=CC=N1 AM20100741 [0,0,0,0,0,1|2,0,1]=4 439 B8R1.2 NCC1=NC=CC=N1 AM91231 [0,0,0,0,0,1|2,0,1]=4 440 B8R1.2 NCC1=NC=CC=N1 AMY10885 [0,0,0,0,0,1|2,0,1]=4 441 B8R1.2 NCC1=NC=CN=C1 AM20070322 [0,0,0,0,0,1|2,0,1]=4 442 B8R1.2 NCC1=NC=NC=C1 AMY15802 [0,0,0,0,0,1|2,0,1]=4 443 B8R1.2 NCC1=NC=NC=C1 AMY33804 [0,0,0,0,0,1|2,0,1]=4 444 B8R1.2 NNC1=CC=CC=C1 AMY22286 [0,0,0,0,0,1|3,0,0]=4 445 B8R1.2 NNC1=CC=CC=C1 AMY22287 [0,0,0,0,0,1|3,0,0]=4 446 B8R1.2 NNC1=CC=CN=C1 AM20061750 [0,0,0,0,0,1|3,0,0]=4 447 B8R1.2 NNC1=CC=CN=C1 AM9980 [0,0,0,0,0,1|3,0,0]=4 448 B8R1.2 NNC1=CC=CN=N1 AMY24923 [0,0,0,0,0,1|3,0,0]=4 449 B8R1.2 NNC1=CC=NC=C1 AM20070158 [0,0,0,0,0,1|3,0,0]=4 450 B8R1.2 NNC1=CC=NC=C1 AMY11940 [0,0,0,0,0,1|3,0,0]=4 451 B8R1.2 NNC1=NC=CC=C1 AM20061254 [0,0,0,0,0,1|3,0,0]=4 452 B8R1.2 NNC1=NC=CC=N1 AM804320 [0,0,0,0,0,1|3,0,0]=4 453 B8R1.2 NNC1=NC=CN=C1 AMY11908 [0,0,0,0,0,1|3,0,0]=4 454 B8R1.2 O=CC1=CC=NC=C1 AM20061563 [0,0,0,0,0,1|1,0,0]=2 455 B8R1.2 O=CC1=CCCCC1 AMY18835 [0,0,0,0,0,1|1,0,2]=4 456 B8R1.2 O=CC1=CCCOC1 AM803164 [0,0,0,0,0,1|0,0,2]=3 457 B8R1.2 O=CC1=CN=CC=C1 AM20061257 [0,0,0,0,0,1|1,0,0]=2 458 B8R1.2 O=CC1=CN=CN=C1 AM20070656 [0,0,0,0,0,1|2,0,0]=3 459 B8R1.2 O=CC1=CN=NC=C1 AM20100248 [0,0,0,0,0,1|2,0,0]=3 460 B8R1.2 O=CC1=NC=CC=C1 AM20050672 [0,0,0,0,0,1|1,0,0]=2 461 B8R1.2 O=CC1=NC=CC=N1 AM20090343 [0,0,0,0,0,1|1,0,0]=2 462 B8R1.2 O=CC1=NC=CN=C1 AM20070428 [0,0,0,0,0,1|1,0,0]=2 463 B8R1.2 O=CC1=NC=NC=C1 AM84826 [0,0,0,0,0,1|1,0,0]=2 464 B8R1.2 O=CC1=NN=CC=C1 AM20100469 [0,0,0,0,0,1|1,0,0]=2 465 B8R1.2 O=NC1=CC=CC=C1 AMY2440 [0,0,0,0,0,1|2,0,0]=3 466 B8R1.2 OCC1=CC=NC=C1 AM804088 [0,0,0,0,0,1|1,0,2]=4 467 B8R1.2 OCC1=CN=CC=C1 AM802808 [0,0,0,0,0,1|1,0,2]=4 468 B8R1.2 OCC1=NC=CC=C1 AM804089 [0,0,0,0,0,1|1,0,2]=4 469 B8R1.2 OCC1=NC=CC=N1 AM20100132 [0,0,0,0,0,1|1,0,2]=4 470 B8R1.2 OCC1=NC=CN=C1 AM20070379 [0,0,0,0,0,1|1,0,2]=4 471 B8R1.2 OCC1=NC=NC=C1 AM20090513 [0,0,0,0,0,1|1,0,2]=4 472 B8R1.2 OCC1=NN=CC=C1 AM20090601 [0,0,0,0,0,1|1,0,2]=4 473 B8R1.2 ONC1=CC=CC=C1 AMY18021 [0,0,0,0,0,1|2,0,1]=4 474 B8R1.2 SCC1=CC=NC=C1 AM100417 [0,0,0,0,0,1|1,1,1]=4 475 B8R1.2 SCC1=CN=CC=C1 AM100385 [0,0,0,0,0,1|1,1,1]=4 476 B8R1.2 SCC1=NC=CC=C1 AM100483 [0,0,0,0,0,1|1,1,1]=4 477 B5R0.1 C=CCC(C)=O AMY31929 [1,0,1,0,0,0|1,0,1]=4 478 B5R0.1 C\C=C\C(=O)O AMY11255 [1,0,1,0,0,0|0,0,1]=3 479 B5R0.1 C\C=C\C(C)=O AMY31928 [1,0,1,0,0,0|1,0,1]=4 480 B5R0.1 O=C(O)\C=C/I AMY22685 [1,0,1,0,0,0|1,0,0]=3 481 B5R0.1 O=C(O)\C=C\I AM806037 [1,0,1,0,0,0|1,0,0]=3 482 B5R0.2 C=CCCC=C AMY18716 [1,0,1,0,0,0|1,0,1]=4 483 B5R0.2 C=CCCC=C AMY19739 [1,0,1,0,0,0|1,0,1]=4 484 B5R0.2 C=CCNC=O AMY24779 [1,0,1,0,0,0|1,0,1]=4 485 B5R0.3 C=CC(=O)CBr AMY31126 [1,0,1,0,0,0|2,0,0]=4 486 B5R0.3 C=CC(O)C=C AMY14244 [1,0,1,0,0,0|1,0,1]=4 487 B5R0.3 COC(=O)C=O AMY1633 [1,0,1,0,0,0|1,0,1]=4 488 B5R1.1 C1=CCOC1 AM81814 [2,0,0,0,0,0|0,0,2]=4 489 B5R1.1 C1=CNC=C1 AMY40221 [2,0,0,0,0,0|1,0,0]=3 490 B5R1.1 C1=CNC=N1 AM82000 [2,0,0,0,0,0|2,0,0]=4 491 B5R1.1 C1=CNC=N1 AMY40451 [2,0,0,0,0,0|2,0,0]=4 492 B5R1.1 C1=CNN=C1 AMY795 [2,0,0,0,0,0|2,0,0]=4 493 B5R1.1 C1=COC=N1 AM20090378 [2,0,0,0,0,0|1,0,0]=3 494 B5R1.1 C1=CON=C1 AM81392 [2,0,0,0,0,0|1,0,0]=3 495 B5R1.1 C1=CSC=N1 AMY5749 [2,0,0,0,0,0|1,1,0]=4 496 B5R1.1 C1=CSN=C1 AMY42108 [2,0,0,0,0,0|1,1,0]=4 497 B7R1.2 BrC1=CC=C(Br)O1 AM20090471 [1,1,0,0,0,0|1,0,0]=3 498 B7R1.2 BrC1=CC=C(Br)S1 AM20090448 [1,1,0,0,0,0|1,1,0]=4 499 B7R1.2 BrC1=CC=C(I)S1 AMY7271 [1,1,0,0,0,0|1,1,0]=4 500 B7R1.2 BrC1=CSC(Br)=C1 AMY2556 [1,1,0,0,0,0|1,1,0]=4 501 B7R1.2 CC1=CC(=O)NO1 AMY22453 [1,1,0,0,0,0|1,0,1]=4 502 B7R1.2 CC1=CC(Br)=CS1 AM20090389 [1,1,0,0,0,0|0,1,1]=4 503 B7R1.2 CC1=CC(Br)=NO1 AM803594 [1,1,0,0,0,0|1,0,1]=4 504 B7R1.2 CC1=CC(C)=NO1 AM20090405 [1,1,0,0,0,0|1,0,1]=4 505 B7R1.2 CC1=CC(Cl)=NO1 AM806513 [1,1,0,0,0,0|1,0,1]=4 506 B7R1.2 CC1=CC(N)=NO1 AM20080024 [1,1,0,0,0,0|1,0,1]=4 507 B7R1.2 CC1=CC=C(Br)O1 AM806617 [1,1,0,0,0,0|0,0,1]=3 508 B7R1.2 CC1=CC=C(Br)S1 AM20100755 [1,1,0,0,0,0|0,1,1]=4 509 B7R1.2 CC1=CC=C(C)O1 AM81813 [1,1,0,0,0,0|0,0,1]=3 510 B7R1.2 CC1=CC=C(Cl)S1 AMY31416 [1,1,0,0,0,0|0,1,1]=4 511 B7R1.2 CC1=CC=C(I)S1 AMY31922 [1,1,0,0,0,0|0,1,1]=4 512 B7R1.2 CC1=CN=C(N)O1 AM803709 [1,1,0,0,0,0|1,0,1]=4 513 B7R1.2 CC1=CNC(C)=C1 AMY3543 [1,1,0,0,0,0|1,0,1]=4 514 B7R1.2 CC1=COC(Br)=N1 AMY23967 [1,1,0,0,0,0|2,0,0]=4 515 B7R1.2 CC1=COC(N)=N1 AM20090562 [1,1,0,0,0,0|2,0,0]=4 516 B7R1.2 CC1=CSC(N)=C1 AM20080364 [1,1,0,0,0,0|1,1,0]=4 517 B7R1.2 CC1=NC(=O)ON1 AM20080700 [1,1,0,0,0,0|2,0,0]=4 518 B7R1.2 CC1=NOC(N)=C1 AM803226 [1,1,0,0,0,0|2,0,0]=4 519 B7R1.2 CC1=NSC(=O)O1 AMY14827 [1,1,0,0,0,0|2,0,0]=4 520 B7R1.2 CN1C=CC(=O)N1 AMY281 [1,1,0,0,0,0|2,0,0]=4 521 B7R1.2 ClC1=CC=C(Cl)S1 AM82002 [1,1,0,0,0,0|1,1,0]=4 522 B7R1.2 NC1=CC(=O)N=N1 AM20100722 [1,1,0,0,0,0|2,0,0]=4 523 B7R1.2 O=C1C=C(Br)CN1 AMY36765 [1,1,0,0,0,0|1,0,1]=4 524 B7R1.2 O=C1C=CC(=O)N1 AMY236 [1,1,0,0,0,0|1,0,0]=3 525 B7R1.2 O=C1C=C[C@@H](O)C1 AMY1807 [1,1,0,0,0,0|1,0,1]=4 526 B7R1.4 BrC1=C(Br)SC=C1 AM20090446 [1,1,0,0,0,0|1,1,0]=4 527 B7R1.4 BrC1=C(I)SC=C1 AMY7304 [1,1,0,0,0,0|1,1,0]=4 528 B7R1.4 C=C1CCOC1=O AMY7315 [1,1,0,0,0,0|0,0,2]=4 529 B7R1.4 CC1=C(Br)C=CS1 AM20090416 [1,1,0,0,0,0|0,1,1]=4 530 B7R1.4 CC1=C(Br)SC=C1 AM20080325 [1,1,0,0,0,0|1,1,0]=4 531 B7R1.4 CC1=C(Cl)SC=C1 AMY23212 [1,1,0,0,0,0|1,1,0]=4 532 B7R1.4 CC1=C(I)C=NO1 AMY24812 [1,1,0,0,0,0|1,0,1]=4 533 B7R1.4 CC1=C(N)OC=N1 AM101230 [1,1,0,0,0,0|2,0,0]=4 534 B7R1.4 CC1=C(S)C=CS1 AMY10940 [1,1,0,0,0,0|0,1,1]=4 535 B7R1.4 CC1=CC=CN1C AMY19099 [1,1,0,0,0,0|1,0,1]=4 536 B7R1.4 CN1NC=CC1=O AMY11909 [1,1,0,0,0,0|2,0,0]=4 537 B7R1.4 CN1SC=CC1=O AM84857 [1,1,0,0,0,0|2,0,0]=4 538 B7R1.4 CN1SC=CC1=O AMY38474 [1,1,0,0,0,0|2,0,0]=4 539 B7R1.4 ClC1=C(Br)C=CS1 AMY7921 [1,1,0,0,0,0|1,1,0]=4 540 B7R1.4 ClC1=C(Cl)SC=C1 AMY22872 [1,1,0,0,0,0|1,1,0]=4 541 B7R1.4 NC1=C(Br)C=CS1 AMY32079 [1,1,0,0,0,0|1,1,0]=4 542 B7R1.14 O=S1(=O)C=CCO1 AMY28660 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.1 C=CC1=CC=C(Br)C=C1 AM84705 [0,1,0,0,0,1|2,0,0]=4 544 B9R1.1 C=CC1=CC=C(Cl)C=C1 AMY40227 [0,1,0,0,0,1|2,0,0]=4 545 B9R1.1 C=CC1=CC=C(F)C=C1 AMY8787 [0,1,0,0,0,1|2,0,0]=4 546 B9R1.1 C=CC1=CC=C(N)C=C1 AMY30222 [0,1,0,0,0,1|2,0,0]=4 547 B9R1.1 C=CC1=CC=C(O)C=C1 AMY18684 [0,1,0,0,0,1|2,0,0]=4 548 B9R1.1 C=CC1=CN=C(C)C=C1 AMY6756 [0,1,0,0,0,1|2,0,0]=4 549 B9R1.1 C=CC1=NC=C(Br)C=N1 AMY20383 [0,1,0,0,0,1|2,0,0]=4 550 B9R1.1 CC1=CN=C(C=O)C=C1 AM20061809 [0,1,0,0,0,1|1,0,0]=3 551 B9R1.1 CC1=CN=C(C=O)C=N1 AMY15960 [0,1,0,0,0,1|1,0,0]=3 552 B9R1.1 CC1=NC=C(C=O)C=C1 AM20061285 [0,1,0,0,0,1|1,0,0]=3 553 B9R1.1 CC1=NC=C(C=O)C=N1 AM20120311 [0,1,0,0,0,1|2,0,0]=4 554 B9R1.1 NC1=NC=C(C=O)C=C1 AMY35066 [0,1,0,0,0,1|1,0,0]=3 555 B9R1.1 NC1=NC=C(C=O)C=C1 AMY39659 [0,1,0,0,0,1|1,0,0]=3 556 B9R1.1 NC1=NC=C(C=O)C=N1 AM20080154 [0,1,0,0,0,1|2,0,0]=4 557 B9R1.1 O=CC1=CC=C(Br)C=C1 AM81352 [0,1,0,0,0,1|1,0,0]=3 558 B9R1.1 O=CC1=CC=C(F)C=C1 AM81268 [0,1,0,0,0,1|1,0,0]=3 559 B9R1.1 O=CC1=CC=C(I)C=C1 AM20030034 [0,1,0,0,0,1|1,0,0]=3 560 B9R1.1 O=CC1=CC=C(O)C=C1 AM10667 [0,1,0,0,0,1|1,0,0]=3 561 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 AMY16360 [0,1,0,0,0,1|1,0,0]=3 562 B9R1.1 O=CC1=CN=C(Br)C=C1 AM20070058 [0,1,0,0,0,1|1,0,0]=3 563 B9R1.1 O=CC1=CN=C(Cl)C=C1 AM20070065 [0,1,0,0,0,1|1,0,0]=3 564 B9R1.1 O=CC1=CN=C(Cl)C=N1 AMY13930 [0,1,0,0,0,1|1,0,0]=3 565 B9R1.1 O=CC1=CN=C(Cl)N=C1 AMY9231 [0,1,0,0,0,1|2,0,0]=4 566 B9R1.1 O=CC1=CN=C(F)C=C1 AMY7971 [0,1,0,0,0,1|1,0,0]=3 567 B9R1.1 O=CC1=CN=C(O)C=C1 AM20070222 [0,1,0,0,0,1|1,0,0]=3 568 B9R1.1 O=CC1=NC=C(Br)C=C1 AM20070096 [0,1,0,0,0,1|1,0,0]=3 569 B9R1.1 O=CC1=NC=C(Cl)C=C1 AM20070226 [0,1,0,0,0,1|1,0,0]=3 570 B9R1.1 O=CC1=NC=C(F)C=C1 AMY7949 [0,1,0,0,0,1|1,0,0]=3 571 B9R1.1 O=CC1=NC=C(O)C=C1 AMY8025 [0,1,0,0,0,1|1,0,0]=3 572 B9R1.1 O=CC1=NN=C(Cl)C=C1 AMY2197 [0,1,0,0,0,1|1,0,0]=3 573 B9R1.1 O=NC1=CC=C(O)C=C1 AM86242 [0,1,0,0,0,1|2,0,0]=4 574 B9R1.2 C=CC1=CC(C)=CC=C1 AMY7013 [0,1,0,0,0,1|2,0,0]=4 575 B9R1.2 C=CC1=CC=CC(Br)=C1 AMY40224 [0,1,0,0,0,1|2,0,0]=4 576 B9R1.2 C=CC1=CC=CC(Cl)=C1 AMY40226 [0,1,0,0,0,1|2,0,0]=4 577 B9R1.2 C=CC1=CC=CC(F)=C1 AM9968 [0,1,0,0,0,1|2,0,0]=4 578 B9R1.2 C=CC1=CC=CC(N)=C1 AMY31946 [0,1,0,0,0,1|2,0,0]=4 579 B9R1.2 CC1=CC(C=O)=CN=C1 AMY30542 [0,1,0,0,0,1|1,0,0]=3 580 B9R1.2 CC1=CC(C=O)=NC=C1 AM804013 [0,1,0,0,0,1|1,0,0]=3 581 B9R1.2 CC1=CC=CC(C=O)=N1 AM20070025 [0,1,0,0,0,1|1,0,0]=3 582 B9R1.2 CC1=CN=CC(C=O)=N1 AM803004 [0,1,0,0,0,1|1,0,0]=3 583 B9R1.2 CC1=NC=CC(C=O)=C1 AM804183 [0,1,0,0,0,1|1,0,0]=3 584 B9R1.2 CC1=NC=CC(C=O)=N1 AMY11013 [0,1,0,0,0,1|1,0,0]=3 585 B9R1.2 NC1=CC=CC(C=O)=C1 AMY14823 [0,1,0,0,0,1|1,0,0]=3 586 B9R1.2 NC1=CC=CC(C=O)=N1 AML0067 [0,1,0,0,0,1|1,0,0]=3 587 B9R1.2 O=CC1=CC(Br)=CN=C1 AM697 [0,1,0,0,0,1|1,0,0]=3 588 B9R1.2 O=CC1=CC(Br)=NC=C1 AM20050698 [0,1,0,0,0,1|1,0,0]=3 589 B9R1.2 O=CC1=CC(Cl)=CN=C1 AM802945 [0,1,0,0,0,1|1,0,0]=3 590 B9R1.2 O=CC1=CC(Cl)=NC=C1 AM20050608 [0,1,0,0,0,1|1,0,0]=3 591 B9R1.2 O=CC1=CC(F)=CN=C1 AMY6738 [0,1,0,0,0,1|1,0,0]=3 592 B9R1.2 O=CC1=CC(F)=NC=C1 AMY23972 [0,1,0,0,0,1|1,0,0]=3 593 B9R1.2 O=CC1=CC(O)=CC=C1 AM10771 [0,1,0,0,0,1|1,0,0]=3 594 B9R1.2 O=CC1=CC(O)=NC=C1 AM803425 [0,1,0,0,0,1|1,0,0]=3 595 B9R1.2 O=CC1=CC=CC(Br)=C1 AM81351 [0,1,0,0,0,1|1,0,0]=3 596 B9R1.2 O=CC1=CC=CC(Br)=N1 AM20051089 [0,1,0,0,0,1|1,0,0]=3 597 B9R1.2 O=CC1=CC=CC(Cl)=C1 AM81267 [0,1,0,0,0,1|1,0,0]=3 598 B9R1.2 O=CC1=CC=CC(Cl)=N1 AMY1936 [0,1,0,0,0,1|1,0,0]=3 599 B9R1.2 O=CC1=CC=CC(F)=C1 AMY8742 [0,1,0,0,0,1|1,0,0]=3 600 B9R1.2 O=CC1=CC=CC(F)=N1 AM20061673 [0,1,0,0,0,1|1,0,0]=3 601 B9R1.2 O=CC1=CC=CC(I)=C1 AM20041027 [0,1,0,0,0,1|1,0,0]=3 602 B9R1.2 O=CC1=CN=CC(O)=C1 AMY8035 [0,1,0,0,0,1|1,0,0]=3 603 B9R1.2 O=CC1=NC=CC(Br)=C1 AM20050767 [0,1,0,0,0,1|1,0,0]=3 604 B9R1.2 O=CC1=NC=CC(Cl)=C1 AM20070229 [0,1,0,0,0,1|1,0,0]=3 605 B9R1.2 O=CC1=NC=CC(F)=C1 AMY17550 [0,1,0,0,0,1|1,0,0]=3 606 B9R1.2 O=CC1=NC=CC(O)=C1 AM20050642 [0,1,0,0,0,1|1,0,0]=3 607 B9R1.6 C=C(F)C1=CC=CC=C1 AMY5811 [0,1,0,0,0,1|2,0,0]=4 608 B9R1.6 CC(=O)C1=CC=NC=C1 AM20050673 [0,1,0,0,0,1|1,0,0]=3 609 B9R1.6 CC(=O)C1=CN=CC=C1 AM20051106 [0,1,0,0,0,1|1,0,0]=3 610 B9R1.6 CC(=O)C1=CN=CN=C1 AM678 [0,1,0,0,0,1|2,0,0]=4 611 B9R1.6 CC(=O)C1=CN=NC=C1 AMY33793 [0,1,0,0,0,1|2,0,0]=4 612 B9R1.6 CC(=O)C1=NC=CC=C1 AM20061676 [0,1,0,0,0,1|1,0,0]=3 613 B9R1.6 CC(=O)C1=NC=CC=N1 AM20120508 [0,1,0,0,0,1|1,0,0]=3 614 B9R1.6 CC(=O)C1=NC=CN=C1 AM20070441 [0,1,0,0,0,1|1,0,0]=3 615 B9R1.6 CC(=O)C1=NN=CC=C1 AM20080074 [0,1,0,0,0,1|1,0,0]=3 616 B9R1.6 N=C(N)C1=CC=CC=C1 AM20030117 [0,1,0,0,0,1|2,0,0]=4 617 B9R1.6 N=C(N)C1=CC=CC=C1 AMY31187 [0,1,0,0,0,1|2,0,0]=4 618 B9R1.6 N=C(N)C1=CC=CN=C1 AMY202100053 [0,1,0,0,0,1|2,0,0]=4 619 B9R1.6 N=C(N)C1=CC=CN=C1 AMY32831 [0,1,0,0,0,1|2,0,0]=4 620 B9R1.6 N=C(N)C1=CC=CN=C1 AMY6593 [0,1,0,0,0,1|2,0,0]=4 621 B9R1.6 N=C(N)C1=CC=NC=C1 AM803711 [0,1,0,0,0,1|2,0,0]=4 622 B9R1.6 N=C(N)C1=CC=NC=C1 AMY11663 [0,1,0,0,0,1|2,0,0]=4 623 B9R1.6 N=C(N)C1=NC=CC=C1 AM20080953 [0,1,0,0,0,1|2,0,0]=4 624 B9R1.6 N=C(N)C1=NC=CC=C1 AM803996 [0,1,0,0,0,1|2,0,0]=4 625 B9R1.6 N=C(N)C1=NC=CC=N1 AM20120505 [0,1,0,0,0,1|2,0,0]=4 626 B9R1.6 N=C(N)C1=NC=CC=N1 AM20120509 [0,1,0,0,0,1|2,0,0]=4 627 B9R1.6 N=C(N)C1=NC=CN=C1 AMY1773 [0,1,0,0,0,1|2,0,0]=4 628 B9R1.6 NC(=O)C1=CC=CC=C1 AMY40917 [0,1,0,0,0,1|1,0,0]=3 629 B9R1.6 NC(=O)C1=CC=NC=C1 AM20061681 [0,1,0,0,0,1|1,0,0]=3 630 B9R1.6 NC(=O)C1=CN=CN=C1 AMY9343 [0,1,0,0,0,1|2,0,0]=4 631 B9R1.6 NC(=O)C1=NC=CC=C1 AM85589 [0,1,0,0,0,1|1,0,0]=3 632 B9R1.6 NC(=O)C1=NC=CC=N1 AM85943 [0,1,0,0,0,1|1,0,0]=3 633 B9R1.6 NC(=O)C1=NC=CN=C1 AMY14180 [0,1,0,0,0,1|1,0,0]=3 634 B9R1.6 NC(=S)C1=CC=CC=C1 AMY13371 [0,1,0,0,0,1|1,1,0]=4 635 B9R1.6 NC(=S)C1=CC=NC=C1 AMY13345 [0,1,0,0,0,1|1,1,0]=4 636 B9R1.6 NC(=S)C1=CN=CC=C1 AMY13354 [0,1,0,0,0,1|1,1,0]=4 637 B9R1.6 O=C(Br)C1=CC=CC=C1 AMY202100108 [0,1,0,0,0,1|1,0,0]=3 638 B9R1.6 O=C(Cl)C1=CC=NC=C1 AM20051141 [0,1,0,0,0,1|1,0,0]=3 639 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM86738 [0,1,0,0,0,1|1,0,0]=3 640 B9R1.6 O=C(Cl)C1=CN=CC=C1 AMY726 [0,1,0,0,0,1|1,0,0]=3 641 B9R1.6 O=C(Cl)C1=CN=CN=C1 AM86113 [0,1,0,0,0,1|2,0,0]=4 642 B9R1.6 O=C(Cl)C1=NC=CC=C1 AM85754 [0,1,0,0,0,1|1,0,0]=3 643 B9R1.6 O=C(O)C1=CC=NC=C1 AM81318 [0,1,0,0,0,1|1,0,0]=3 644 B9R1.6 O=C(O)C1=CCCCO1 AMY25035 [0,1,0,0,0,1|0,0,2]=4 645 B9R1.6 O=C(O)C1=CN=CC=C1 AM81316 [0,1,0,0,0,1|1,0,0]=3 646 B9R1.6 O=C(O)C1=CN=CN=C1 AM20100174 [0,1,0,0,0,1|2,0,0]=4 647 B9R1.6 O=C(O)C1=CN=NC=C1 AM20100245 [0,1,0,0,0,1|2,0,0]=4 648 B9R1.6 O=C(O)C1=NC=CC=C1 AM81303 [0,1,0,0,0,1|1,0,0]=3 649 B9R1.6 O=C(O)C1=NC=CC=N1 AM20090451 [0,1,0,0,0,1|1,0,0]=3 650 B9R1.6 O=C(O)C1=NC=CN=C1 AM20070429 [0,1,0,0,0,1|1,0,0]=3 651 B9R1.6 O=C(O)C1=NC=NC=C1 AM20090449 [0,1,0,0,0,1|1,0,0]=3 652 B9R1.6 O=C(O)C1=NN=CC=C1 AMY24938 [0,1,0,0,0,1|1,0,0]=3 653 B9R1.6 O=C([O-])C1=CC=CC=C1 AMY11769 [0,1,0,0,0,1|1,0,0]=3 654 B9R1.6 O=C([O-])C1=NC=CC=C1 AMY19817 [0,1,0,0,0,1|1,0,0]=3 655 B9R1.6 O=[N+]([O-])C1=CN=CC=C1 AMY23871 [0,1,0,0,0,1|2,0,0]=4 656 B9R1.8 C\N=C\C1=CC=CC=C1 AMY11008 [0,1,0,0,0,1|2,0,0]=4 657 B9R1.8 O=C=NC1=CN=CC=C1 AMY756 [0,1,0,0,0,1|1,0,1]=4 658 B9R1.8 O=C=NC1=NC=CC=C1 AMY16299 [0,1,0,0,0,1|1,0,1]=4 659 B9R1.8 O=CCC1=NC=CC=C1 AMY30401 [0,1,0,0,0,1|1,0,0]=3 660 B9R1.8 O=S=NC1=CC=CC=C1 AMY31360 [0,1,0,0,0,1|2,0,0]=4 661 B9R1.8 O\N=C\C1=CC=NC=C1 AMY40496 [0,1,0,0,0,1|1,0,1]=4 662 B9R1.15 C=CC1=C(Br)C=CC=C1 AMY40223 [0,1,0,0,0,1|2,0,0]=4 663 B9R1.15 C=CC1=C(C)C=CC=C1 AMY13657 [0,1,0,0,0,1|2,0,0]=4 664 B9R1.15 C=CC1=C(C)C=CN=C1 AMY35781 [0,1,0,0,0,1|2,0,0]=4 665 B9R1.15 C=CC1=C(Cl)C=CC=C1 AMY31202 [0,1,0,0,0,1|2,0,0]=4 666 B9R1.15 C=CC1=C(F)C=CC=C1 AM61526 [0,1,0,0,0,1|2,0,0]=4 667 B9R1.15 CC1=C(C=O)C=CC=N1 AMY23019 [0,1,0,0,0,1|1,0,0]=3 668 B9R1.15 CC1=C(C=O)C=NC=C1 AMY11798 [0,1,0,0,0,1|1,0,0]=3 669 B9R1.15 CC1=CC=CN=C1C=O AM20061323 [0,1,0,0,0,1|1,0,0]=3 670 B9R1.15 CC1=NC=CN=C1C=O AM807037 [0,1,0,0,0,1|1,0,0]=3 671 B9R1.15 NC1=C(C=O)C=CC=C1 AMY4000 [0,1,0,0,0,1|1,0,0]=3 672 B9R1.15 NC1=C(C=O)C=CC=N1 AM20070035 [0,1,0,0,0,1|1,0,0]=3 673 B9R1.15 NC1=C(C=O)C=CN=C1 AM20061317 [0,1,0,0,0,1|1,0,0]=3 674 B9R1.15 NC1=C(C=O)C=NC=C1 AM20051172 [0,1,0,0,0,1|1,0,0]=3 675 B9R1.15 NC1=C(C=O)C=NC=N1 AMY15855 [0,1,0,0,0,1|2,0,0]=4 676 B9R1.15 NC1=CC=CN=C1C=O AMY19104 [0,1,0,0,0,1|1,0,0]=3 677 B9R1.15 NC1=NC=CN=C1C=O AM20070419 [0,1,0,0,0,1|1,0,0]=3 678 B9R1.15 O=CC1=C(Br)C=CC=C1 AM81350 [0,1,0,0,0,1|1,0,0]=3 679 B9R1.15 O=CC1=C(Br)C=CC=N1 AMY15171 [0,1,0,0,0,1|1,0,0]=3 680 B9R1.15 O=CC1=C(Br)C=CN=C1 AM20050835 [0,1,0,0,0,1|1,0,0]=3 681 B9R1.15 O=CC1=C(Br)C=CN=C1 AMY34957 [0,1,0,0,0,1|1,0,0]=3 682 B9R1.15 O=CC1=C(Br)C=NC=C1 AM20061457 [0,1,0,0,0,1|1,0,0]=3 683 B9R1.15 O=CC1=C(Br)C=NC=N1 AMY15282 [0,1,0,0,0,1|1,0,0]=3 684 B9R1.15 O=CC1=C(Cl)C=CC=C1 AMY39073 [0,1,0,0,0,1|1,0,0]=3 685 B9R1.15 O=CC1=C(Cl)C=CC=N1 AMY6731 [0,1,0,0,0,1|1,0,0]=3 686 B9R1.15 O=CC1=C(Cl)C=CN=C1 AM802948 [0,1,0,0,0,1|1,0,0]=3 687 B9R1.15 O=CC1=C(Cl)C=NC=C1 AM20061811 [0,1,0,0,0,1|1,0,0]=3 688 B9R1.15 O=CC1=C(F)C=CC=C1 AMY8706 [0,1,0,0,0,1|1,0,0]=3 689 B9R1.15 O=CC1=C(F)C=CC=N1 AM20070289 [0,1,0,0,0,1|1,0,0]=3 690 B9R1.15 O=CC1=C(F)C=NC=C1 AM20080701 [0,1,0,0,0,1|1,0,0]=3 691 B9R1.15 O=CC1=C(I)C=CC=C1 AM20040047 [0,1,0,0,0,1|1,0,0]=3 692 B9R1.15 O=CC1=C(O)C=NC=C1 AM807039 [0,1,0,0,0,1|1,0,0]=3 693 B9R1.15 O=CC1=C(S)C=CC=C1 AM806659 [0,1,0,0,0,1|1,0,0]=3 694 B9R1.15 O=CC1=CC=CN=C1Br AM20050750 [0,1,0,0,0,1|1,0,0]=3 695 B9R1.15 O=CC1=CC=CN=C1Cl AM20051116 [0,1,0,0,0,1|1,0,0]=3 696 B9R1.15 O=CC1=CC=CN=C1F AM20070136 [0,1,0,0,0,1|1,0,0]=3 697 B9R1.15 O=CC1=CC=CNC1=O AM20070207 [0,1,0,0,0,1|1,0,0]=3 698 B9R1.15 O=CC1=CN=CN=C1Cl AMY15860 [0,1,0,0,0,1|2,0,0]=4 699 B9R1.15 O=CC1=NC=CC=C1O AMY31181 [0,1,0,0,0,1|1,0,0]=3 700 B9R1.15 O=CC1=NC=CN=C1Cl AMY15886 [0,1,0,0,0,1|1,0,0]=3 701 B9R1.7 CC1=CC=C(CCO)O1 AMY16284 [0,2,0,0,0,0|0,0,2]=4 702 B9R1.7 ON=CC1=CC=C(Br)S1 AM84760 [0,2,0,0,0,0|0,1,1]=4 703 B9R1.7 O\N=C\C1=CC(Br)=CS1 AMY27433 [0,2,0,0,0,0|0,1,1]=4 704 B9R1.21 CCN1C=CC(C=O)=N1 AM20120365 [0,2,0,0,0,0|2,0,0]=4 705 B9R1.21 COC1=NC=C(C=O)S1 AM20120377 [0,2,0,0,0,0|1,1,0]=4 706 B9R1.21 N#CC1=CC=C(C=O)O1 AM20100114 [0,2,0,0,0,0|0,0,0]=2 707 B9R1.21 N#CC1=CC=C(C=O)S1 AMY3040 [0,2,0,0,0,0|0,1,0]=3 708 B9R1.21 N#CC1=CNC(C=O)=C1 AMY16253 [0,2,0,0,0,0|1,0,0]=3 709 B9R1.21 NCC1=CC=C(CN)O1 AMY7024 [0,2,0,0,0,0|1,0,1]=4 710 B9R1.21 O=CC1=CC(CO)=CO1 AMY41823 [0,2,0,0,0,0|0,0,0]=2 711 B9R1.21 O=CC1=CC=C(C=O)N1 AMY19240 [0,2,0,0,0,0|1,0,0]=3 712 B9R1.21 O=CC1=CC=C(C=O)O1 AM20080614 [0,2,0,0,0,0|0,0,0]=2 713 B9R1.21 O=CC1=CC=C(C=O)S1 AM20080613 [0,2,0,0,0,0|0,1,0]=3 714 B9R1.21 O=CC1=CC=C(CO)O1 AM20100616 [0,2,0,0,0,0|0,0,0]=2 715 B9R1.21 OCC1=CC=C(CO)O1 AM20090102 [0,2,0,0,0,0|0,0,2]=4 716 B9R1.22 CC1=C(C=O)N=C(N)S1 AMY39217 [0,2,0,0,0,0|2,0,0]=4 717 B9R1.22 CC1=CC(C)=C(C=O)N1 AM20090211 [0,2,0,0,0,0|1,0,0]=3 718 B9R1.22 CC1=NC(C)=C(C=O)O1 AM20100641 [0,2,0,0,0,0|1,0,0]=3 719 B9R1.22 CC1=NC(C)=C(C=O)S1 AM804605 [0,2,0,0,0,0|1,1,0]=4 720 B9R1.22 CC1=NC(C=O)=C(C)N1 AM806621 [0,2,0,0,0,0|2,0,0]=4 721 B9R1.22 CC1=NN(C)C(C=O)=C1 AMY11412 [0,2,0,0,0,0|2,0,0]=4 722 B9R1.22 CN1C=C(Br)C(C=O)=N1 AMY11933 [0,2,0,0,0,0|2,0,0]=4 723 B9R1.22 CN1C=C(I)C(C=O)=N1 AMY18603 [0,2,0,0,0,0|2,0,0]=4 724 B9R1.22 NC1=NC(Cl)=C(C=O)S1 AMY31385 [0,2,0,0,0,0|1,1,0]=4 725 B9R1.22 O=CC1=C(Br)N=C(Br)S1 AM20080296 [0,2,0,0,0,0|1,1,0]=4 726 B9R1.22 O=CC1=C(Br)SC(Br)=C1 AMY7254 [0,2,0,0,0,0|2,0,0]=4 727 B9R1.22 O=CC1=C(Cl)N=C(Cl)S1 AM20120335 [0,2,0,0,0,0|1,1,0]=4 728 B9R1.22 O=CC1=C(Cl)SC(Cl)=C1 AM20100489 [0,2,0,0,0,0|2,0,0]=4 729 B9R1.23 CC1=C(Br)SC(C=O)=C1 AM90071 [0,2,0,0,0,0|0,1,0]=3 730 B9R1.23 CC1=C(C)SC(C=O)=N1 AMY26842 [0,2,0,0,0,0|1,1,0]=4 731 B9R1.23 CC1=CC(C=O)=NN1C AM85680 [0,2,0,0,0,0|2,0,0]=4 732 B9R1.23 O=CC1=CC(Br)=C(Br)N1 AMY19072 [0,2,0,0,0,0|1,0,0]=3 733 B9R1.35 CC(=O)C1=CC(Br)=CS1 AMY16069 [0,2,0,0,0,0|0,1,0]=3 734 B9R1.35 CC(=O)C1=CC(C)=NO1 AMY9354 [0,2,0,0,0,0|1,0,0]=3 735 B9R1.35 CC(=O)C1=CC(Cl)=CS1 AMY40541 [0,2,0,0,0,0|0,1,0]=3 736 B9R1.35 CC(=O)C1=CC(N)=NN1 AMY34087 [0,2,0,0,0,0|2,0,0]=4 737 B9R1.35 CC(=O)C1=CC=C(Br)S1 AMY14215 [0,2,0,0,0,0|0,1,0]=3 738 B9R1.35 CC(=O)C1=CC=C(Cl)S1 AM20100558 [0,2,0,0,0,0|0,1,0]=3 739 B9R1.35 CC(=O)C1=CN=C(N)S1 AMY34510 [0,2,0,0,0,0|1,1,0]=4 740 B9R1.35 CC(=O)C1=CSC(N)=N1 AM20070661 [0,2,0,0,0,0|2,0,0]=4 741 B9R1.35 CC(=O)C1=NC(Br)=CS1 AMY42165 [0,2,0,0,0,0|1,1,0]=4 742 B9R1.35 CC(=O)C1=NOC(C)=C1 AM803572 [0,2,0,0,0,0|2,0,0]=4 743 B9R1.35 CC1=CC(C(=O)Cl)=NO1 AMY13358 [0,2,0,0,0,0|2,0,0]=4 744 B9R1.35 CC1=CC(C(=O)O)=CO1 AMY19573 [0,2,0,0,0,0|2,0,0]=4 745 B9R1.35 CC1=CC(C(=O)O)=NN1 AM20100068 [0,2,0,0,0,0|2,0,0]=4 746 B9R1.35 CC1=CC(C(=O)O)=NO1 AM20090521 [0,2,0,0,0,0|2,0,0]=4 747 B9R1.35 CC1=CC=C(B(O)O)O1 AM87100 [0,2,0,0,0,0|1,0,1]=4 748 B9R1.35 CC1=CC=C(C(=O)O)N1 AMY4812 [0,2,0,0,0,0|1,0,0]=3 749 B9R1.35 CC1=CC=C(C(=O)O)O1 AM20090119 [0,2,0,0,0,0|0,0,0]=2 750 B9R1.35 CC1=CC=C(C(=O)O)S1 AM20090123 [0,2,0,0,0,0|0,1,0]=3 751 B9R1.35 CC1=CN=C(C(=O)O)O1 AMY2485 [0,2,0,0,0,0|1,0,0]=3 752 B9R1.35 CC1=CN=C(C(=O)O)S1 AM20100492 [0,2,0,0,0,0|1,1,0]=4 753 B9R1.35 CC1=CN=C(C(=O)[O-])O1 AMY35414 [0,2,0,0,0,0|1,0,0]=3 754 B9R1.35 CC1=CNC(C(=O)O)=C1 AMY14426 [0,2,0,0,0,0|1,0,0]=3 755 B9R1.35 CC1=CNC(C(=O)O)=N1 AMY6496 [0,2,0,0,0,0|2,0,0]=4 756 B9R1.35 CC1=CSC(C(=O)O)=C1 AM803213 [0,2,0,0,0,0|0,1,0]=3 757 B9R1.35 CC1=CSC(C(=O)O)=N1 AM20080346 [0,2,0,0,0,0|1,1,0]=4 758 B9R1.35 CC1=NC(C(=O)O)=CN1 AM84418 [0,2,0,0,0,0|2,0,0]=4 759 B9R1.35 CC1=NC(C(=O)O)=CO1 AM20090243 [0,2,0,0,0,0|2,0,0]=4 760 B9R1.35 CC1=NC(C(=O)O)=CS1 AM803762 [0,2,0,0,0,0|2,0,0]=4 761 B9R1.35 CC1=NC(C(N)=O)=CO1 AM85441 [0,2,0,0,0,0|2,0,0]=4 762 B9R1.35 CC1=NC=C(C(=O)O)S1 AM20100059 [0,2,0,0,0,0|1,1,0]=4 763 B9R1.35 CC1=NN=C(C(=O)[O-])O1 AM85947 [0,2,0,0,0,0|2,0,0]=4 764 B9R1.35 CC1=NNC(C(=O)O)=C1 AM804242 [0,2,0,0,0,0|2,0,0]=4 765 B9R1.35 CC1=NOC(C(=O)O)=C1 AM20100200 [0,2,0,0,0,0|1,0,0]=3 766 B9R1.35 CC1=NOC(C(=O)[O-])=N1 AMY26580 [0,2,0,0,0,0|2,0,0]=4 767 B9R1.35 CN1C=CC(C(=O)O)=C1 AM803787 [0,2,0,0,0,0|2,0,0]=4 768 B9R1.35 CN1C=CC(C(=O)O)=N1 AM20090287 [0,2,0,0,0,0|2,0,0]=4 769 B9R1.35 CN1C=CC(C(N)=O)=N1 AMY33020 [0,2,0,0,0,0|2,0,0]=4 770 B9R1.35 CN1C=NC(C(=O)O)=C1 AM20100101 [0,2,0,0,0,0|2,0,0]=4 771 B9R1.35 NC(=O)C1=CC=C(Br)O1 AMY17746 [0,2,0,0,0,0|0,0,0]=2 772 B9R1.35 NC(=O)C1=CN=C(Br)S1 AMY4699 [0,2,0,0,0,0|1,1,0]=4 773 B9R1.35 NC(=O)C1=NNC(N)=C1 AMY20380 [0,2,0,0,0,0|2,0,0]=4 774 B9R1.35 NC1=CC(C(=O)O)=NN1 AMY16192 [0,2,0,0,0,0|2,0,0]=4 775 B9R1.35 NC1=CNC(C(=O)O)=C1 AMY16178 [0,2,0,0,0,0|1,0,0]=3 776 B9R1.35 NC1=NC(C(=O)O)=CS1 AMY10352 [0,2,0,0,0,0|2,0,0]=4 777 B9R1.35 NC1=NC=C(C(=O)O)S1 AM20100074 [0,2,0,0,0,0|1,1,0]=4 778 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 AM20090749 [0,2,0,0,0,0|0,1,0]=3 779 B9R1.35 O=C(O)C1=CC(Br)=CN1 AM20090350 [0,2,0,0,0,0|1,0,0]=3 780 B9R1.35 O=C(O)C1=CC(Br)=CO1 AMY6482 [0,2,0,0,0,0|0,0,0]=2 781 B9R1.35 O=C(O)C1=CC(Br)=CS1 AM20090001 [0,2,0,0,0,0|0,1,0]=3 782 B9R1.35 O=C(O)C1=CC(Br)=NO1 AM9953 [0,2,0,0,0,0|1,0,0]=3 783 B9R1.35 O=C(O)C1=CC(O)=NO1 AM20080267 [0,2,0,0,0,0|1,0,0]=3 784 B9R1.35 O=C(O)C1=CC=C(Br)O1 AM20100426 [0,2,0,0,0,0|0,0,0]=2 785 B9R1.35 O=C(O)C1=CC=C(Br)S1 AM20100699 [0,2,0,0,0,0|0,1,0]=3 786 B9R1.35 O=C(O)C1=CC=C(Cl)O1 AMY3036 [0,2,0,0,0,0|0,0,0]=2 787 B9R1.35 O=C(O)C1=CC=C(Cl)S1 AM20090264 [0,2,0,0,0,0|0,1,0]=3 788 B9R1.35 O=C(O)C1=CC=C(F)S1 AMY23549 [0,2,0,0,0,0|0,1,0]=3 789 B9R1.35 O=C(O)C1=CN=C(Br)S1 AM20100332 [0,2,0,0,0,0|1,1,0]=4 790 B9R1.35 O=C(O)C1=CN=C(Cl)S1 AMY18838 [0,2,0,0,0,0|1,1,0]=4 791 B9R1.35 O=C(O)C1=CNC(Cl)=C1 AM806417 [0,2,0,0,0,0|2,0,0]=4 792 B9R1.35 O=C(O)C1=CSC(Br)=C1 AM20070652 [0,2,0,0,0,0|2,0,0]=4 793 B9R1.35 O=C(O)C1=CSC(Br)=N1 AM20100280 [0,2,0,0,0,0|2,0,0]=4 794 B9R1.35 O=C(O)C1=CSC(Cl)=C1 AMY22975 [0,2,0,0,0,0|2,0,0]=4 795 B9R1.35 O=C(O)C1=NC(Br)=CS1 AM20120282 [0,2,0,0,0,0|1,1,0]=4 796 B9R1.35 O=C(O)C1=NC(I)=CN1 AMY17524 [0,2,0,0,0,0|2,0,0]=4 797 B9R1.35 O=C(O)C1=NC=C(Br)S1 AMY33909 [0,2,0,0,0,0|1,1,0]=4 798 B9R1.35 O=C(O)C1=NNC(Br)=C1 AMY11958 [0,2,0,0,0,0|2,0,0]=4 799 B9R1.35 O=C(O)C1=NNC(Cl)=C1 AMY12071 [0,2,0,0,0,0|2,0,0]=4 800 B9R1.35 O=C1C=C(C(=O)O)CC1 AMY36569 [0,2,0,0,0,0|1,0,1]=4 801 B9R1.35 O=C1NC=C(C(=O)O)N1 AMY5017 [0,2,0,0,0,0|2,0,0]=4 802 B9R1.35 O=[N+]([O-])C1=CC=C(Br)S1 AMY20173 [0,2,0,0,0,0|1,1,0]=4 803 B9R1.132 CC1=CNC(C=O)=C1C AMY33666 [0,2,0,0,0,0|1,0,0]=3 804 B9R1.132 CC1=NC=C(C=O)N1C AMY30978 [0,2,0,0,0,0|2,0,0]=4 805 B9R1.132 O=CC1=C(Br)C(Br)=CS1 AMY31972 [0,2,0,0,0,0|0,1,0]=3 806 B9R1.11 CCC(=O)C1=CC=CN1 AM802893 [0,2,0,0,0,0|1,0,0]=3 807 B9R1.11 CCC(=O)C1=CC=CS1 AMY39126 [0,2,0,0,0,0|0,1,0]=3 808 B9R1.11 COC(=O)C1=CC=CN1 AM20080137 [0,2,0,0,0,0|1,0,0]=3 809 B9R1.11 COC(=O)C1=CC=CO1 AM20100488 [0,2,0,0,0,0|0,0,0]=2 810 B9R1.11 COC(=O)C1=CC=CS1 AMY10146 [0,2,0,0,0,0|0,1,0]=3 811 B9R1.11 COC(=O)C1=CC=NO1 AMY38613 [0,2,0,0,0,0|1,0,0]=3 812 B9R1.11 COC(=O)C1=CN=CO1 AMY10991 [0,2,0,0,0,0|1,0,0]=3 813 B9R1.11 COC(=O)C1=CN=CS1 AM20080344 [0,2,0,0,0,0|1,1,0]=4 814 B9R1.11 COC(=O)C1=CNC=C1 AM20080911 [0,2,0,0,0,0|2,0,0]=4 815 B9R1.11 COC(=O)C1=CNC=N1 AM20090030 [0,2,0,0,0,0|2,0,0]=4 816 B9R1.11 COC(=O)C1=CSC=N1 AMY9336 [0,2,0,0,0,0|2,0,0]=4 817 B9R1.11 COC(=O)C1=NC=CN1 AMY3870 [0,2,0,0,0,0|2,0,0]=4 818 B9R1.11 COC(=O)C1=NNC=C1 AM20080390 [0,2,0,0,0,0|2,0,0]=4 819 B9R1.11 COC(=O)C1=NOC=C1 AMY12175 [0,2,0,0,0,0|2,0,0]=4 820 B9R1.11 COC(=O)N1C=CC=C1 AMY31740 [0,2,0,0,0,0|2,0,0]=4 821 B9R1.11 NCC(=O)C1=CC=CN1 AM101383 [0,2,0,0,0,0|1,0,0]=3 822 B9R1.11 NCC(=O)C1=CC=CO1 AM101773 [0,2,0,0,0,0|0,0,0]=2 823 B9R1.11 NCC(=O)C1=CC=CO1 AMY15091 [0,2,0,0,0,0|0,0,0]=2 824 B9R1.11 NCC(=O)C1=CC=CS1 AM100654 [0,2,0,0,0,0|0,1,0]=3 825 B9R1.11 NCC(=O)C1=CC=CS1 AM101175 [0,2,0,0,0,0|0,1,0]=3 826 B9R1.11 NCC(=O)C1=NC=CS1 AM100290 [0,2,0,0,0,0|1,1,0]=4 827 B9R1.11 NC[C@H](O)C1=CC=CO1 AM803620 [0,2,0,0,0,0|0,0,2]=4 828 B9R1.11 NNC(=O)C1=CC=CO1 AM10044 [0,2,0,0,0,0|0,0,0]=2 829 B9R1.11 NNC(=O)C1=CC=CS1 AM9858 [0,2,0,0,0,0|0,1,0]=3 830 B9R1.11 O=C(CBr)C1=CC=CN1 AM101209 [0,2,0,0,0,0|1,0,0]=3 831 B9R1.11 O=C(CBr)C1=CC=CO1 AM100277 [0,2,0,0,0,0|0,0,0]=2 832 B9R1.11 O=C(CBr)C1=CC=CS1 AM90541 [0,2,0,0,0,0|0,1,0]=3 833 B9R1.11 O=C(CBr)C1=NC=CS1 AM100666 [0,2,0,0,0,0|1,1,0]=4 834 B9R1.11 OC[C@@H](O)C1=CC=CO1 AMY16113 [0,2,0,0,0,0|0,0,2]=4 835 B9R1.19 NS(=O)(=O)C1=CC=CS1 AM20100568 [0,2,0,0,0,0|1,1,0]=4 836 B9R1.19 O=S(=O)(Cl)C1=CC=CS1 AM20080472 [0,2,0,0,0,0|1,1,0]=4 837 B9R1.19 O=S(=O)(O)C1=CC=CS1 AM101285 [0,2,0,0,0,0|1,1,0]=4 838 B9R1.41 CC(=O)C1=C(C)N=CO1 AM81168 [0,2,0,0,0,0|1,0,0]=3 839 B9R1.41 CC(=O)C1=C(N)C=CS1 AMY15081 [0,2,0,0,0,0|0,1,0]=3 840 B9R1.41 CC(=O)C1=CC=CN1C AMY23202 [0,2,0,0,0,0|1,0,0]=3 841 B9R1.41 CC(=O)C1=CC=NN1C AM803189 [0,2,0,0,0,0|2,0,0]=4 842 B9R1.41 CC(=O)C1=CNC=C1C AM20080563 [0,2,0,0,0,0|2,0,0]=4 843 B9R1.41 CC(=O)C1=NC=CN1C AM101361 [0,2,0,0,0,0|2,0,0]=4 844 B9R1.41 CC1=C(C(=O)Cl)OC=N1 AM101041 [0,2,0,0,0,0|1,0,0]=3 845 B9R1.41 CC1=C(C(=O)O)C=CN1 AM803795 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.41 CC1=C(C(=O)O)C=CS1 AM20090122 [0,2,0,0,0,0|2,0,0]=4 847 B9R1.41 CC1=C(C(=O)O)N=CO1 AM20070688 [0,2,0,0,0,0|2,0,0]=4 848 B9R1.41 CC1=C(C(=O)O)N=CS1 AMY22904 [0,2,0,0,0,0|2,0,0]=4 849 B9R1.41 CC1=C(C(=O)O)NC=N1 AM803223 [0,2,0,0,0,0|2,0,0]=4 850 B9R1.41 CC1=C(C(=O)O)OC=C1 AMY11077 [0,2,0,0,0,0|0,0,0]=2 851 B9R1.41 CC1=C(C(=O)O)OC=N1 AM20090289 [0,2,0,0,0,0|1,0,0]=3 852 B9R1.41 CC1=C(C(=O)O)ON=C1 AM807046 [0,2,0,0,0,0|1,0,0]=3 853 B9R1.41 CC1=C(C(=O)O)SC=C1 AM20090260 [0,2,0,0,0,0|0,1,0]=3 854 B9R1.41 CC1=C(C(=O)O)SC=N1 AM20090160 [0,2,0,0,0,0|1,1,0]=4 855 B9R1.41 CC1=CNC=C1C(=O)O AM804187 [0,2,0,0,0,0|2,0,0]=4 856 B9R1.41 CC1=CNN=C1C(=O)O AMY9299 [0,2,0,0,0,0|2,0,0]=4 857 B9R1.41 CC1=CSC=C1C(=O)O AM81205 [0,2,0,0,0,0|2,0,0]=4 858 B9R1.41 CN1C=CC=C1C(=O)O AMY9276 [0,2,0,0,0,0|1,0,0]=3 859 B9R1.41 CN1C=CN=C1C(=O)O AM803482 [0,2,0,0,0,0|2,0,0]=4 860 B9R1.41 CN1C=NC=C1C(=O)Cl AMY24826 [0,2,0,0,0,0|2,0,0]=4 861 B9R1.41 CN1C=NC=C1C(=O)O AM20100108 [0,2,0,0,0,0|2,0,0]=4 862 B9R1.41 CN1N=CC=C1C(=O)O AM20080432 [0,2,0,0,0,0|2,0,0]=4 863 B9R1.41 NC(=O)C1=C(N)N=CN1 AM20090183 [0,2,0,0,0,0|2,0,0]=4 864 B9R1.41 NC(=O)C1=C(N)N=CN1 AMY4093 [0,2,0,0,0,0|2,0,0]=4 865 B9R1.41 NC(=O)C1=C(N)NC=N1 AM20090571 [0,2,0,0,0,0|2,0,0]=4 866 B9R1.41 NC(=O)C1=C(N)SC=C1 AM20080308 [0,2,0,0,0,0|2,0,0]=4 867 B9R1.41 NC(=O)C1=C(N)SC=N1 AMY7744 [0,2,0,0,0,0|2,0,0]=4 868 B9R1.41 NC(=O)C1=C(O)C=CS1 AMY32355 [0,2,0,0,0,0|0,1,0]=3 869 B9R1.41 NC(=O)C1=C(O)NC=N1 AMY15291 [0,2,0,0,0,0|2,0,0]=4 870 B9R1.41 NC(=O)C1=CC=CN1N AM84525 [0,2,0,0,0,0|1,0,0]=3 871 B9R1.41 NC(=O)C1=CC=CN1N AMY34577 [0,2,0,0,0,0|1,0,0]=3 872 B9R1.41 NC(=O)C1=NNC=C1Br AMY10505 [0,2,0,0,0,0|2,0,0]=4 873 B9R1.41 O=C(O)C1=C(Br)C=CN1 AMY39753 [0,2,0,0,0,0|1,0,0]=3 874 B9R1.41 O=C(O)C1=C(Br)C=CO1 AM20080374 [0,2,0,0,0,0|0,0,0]=2 875 B9R1.41 O=C(O)C1=C(Br)C=CS1 AM20100700 [0,2,0,0,0,0|0,1,0]=3 876 B9R1.41 O=C(O)C1=C(Br)C=NN1 AMY41335 [0,2,0,0,0,0|2,0,0]=4 877 B9R1.41 O=C(O)C1=C(Br)N=CS1 AMY15996 [0,2,0,0,0,0|1,1,0]=4 878 B9R1.41 O=C(O)C1=C(Br)OC=C1 AMY19555 [0,2,0,0,0,0|2,0,0]=4 879 B9R1.41 O=C(O)C1=C(Br)SC=C1 AMY7270 [0,2,0,0,0,0|2,0,0]=4 880 B9R1.41 O=C(O)C1=C(Br)SC=N1 AMY15991 [0,2,0,0,0,0|2,0,0]=4 881 B9R1.41 O=C(O)C1=C(Cl)C=NS1 AMY18742 [0,2,0,0,0,0|1,1,0]=4 882 B9R1.41 O=C(O)C1=C(Cl)N=CS1 AMY1637 [0,2,0,0,0,0|1,1,0]=4 883 B9R1.41 O=C(O)C1=C(Cl)SC=C1 AMY7906 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.41 O=C(O)C1=C(F)C=CS1 AMY15182 [0,2,0,0,0,0|0,1,0]=3 885 B9R1.41 O=C(O)C1=C(I)C=CS1 AM86013 [0,2,0,0,0,0|0,1,0]=3 886 B9R1.41 O=C(O)C1=C(I)C=NN1 AM101113 [0,2,0,0,0,0|2,0,0]=4 887 B9R1.41 O=C(O)C1=C(O)C=CS1 AMY42066 [0,2,0,0,0,0|0,1,0]=3 888 B9R1.41 O=C(O)C1=CSC=C1Br AM81153 [0,2,0,0,0,0|2,0,0]=4 889 B9R1.41 O=C(O)C1=NNC=C1Br AMY6478 [0,2,0,0,0,0|2,0,0]=4 890 B9R1.41 O=C(O)C1=NNC=C1Cl AM20110213 [0,2,0,0,0,0|2,0,0]=4 891 B9R1.41 O=[N+]([O-])C1=C(Br)C=CS1 AM9775 [0,2,0,0,0,0|1,1,0]=4 892 B9R1.12 O=C\C=C\C1=COC=C1 AM806657 [0,2,0,0,0,0|2,0,0]=4 893 B9R1.13 CC(=O)NC1=CC=CS1 AM20080217 [0,2,0,0,0,0|0,1,0]=3 894 B9R1.13 CC(=O)NC1=CSC=C1 AMY2018 [0,2,0,0,0,0|2,0,0]=4 895 B9R1.13 CC(=O)NC1=NC=CS1 AMY24875 [0,2,0,0,0,0|1,1,0]=4 896 B9R1.13 NC(=O)CC1=CC=CN1 AM806500 [0,2,0,0,0,0|1,0,0]=3 897 B9R1.13 O=C(Cl)CC1=CC=CS1 AM20100031 [0,2,0,0,0,0|0,1,0]=3 898 B9R1.13 O=C(O)CC1=CC=CO1 AMY31140 [0,2,0,0,0,0|0,0,0]=2 899 B9R1.13 O=C(O)CC1=CC=CS1 AM20090121 [0,2,0,0,0,0|0,1,0]=3 900 B9R1.13 O=C(O)CC1=CC=NN1 AMY23473 [0,2,0,0,0,0|2,0,0]=4 901 B9R1.13 O=C(O)CC1=CNC=N1 AM20090474 [0,2,0,0,0,0|2,0,0]=4 902 B9R1.13 O=C(O)CC1=CNC=N1 AMY39839 [0,2,0,0,0,0|2,0,0]=4 903 B9R1.13 O=C(O)CC1=COC=C1 AMY16301 [0,2,0,0,0,0|2,0,0]=4 904 B9R1.13 O=C(O)CC1=CSC=C1 AM20100656 [0,2,0,0,0,0|2,0,0]=4 905 B9R1.13 O=C(O)CC1=NC=CN1 AMY11886 [0,2,0,0,0,0|2,0,0]=4 906 B9R1.13 O=C(O)CC1=NNC=C1 AMY23511 [0,2,0,0,0,0|2,0,0]=4 907 B9R1.13 O=C(O)CN1C=CC=N1 AM20080433 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.14 CCN1C=CN=C1C=O AM90664 [0,2,0,0,0,0|2,0,0]=4 909 B9R1.14 CCN1N=CC=C1C=O AMY32928 [0,2,0,0,0,0|2,0,0]=4 910 B9R1.14 COC1=C(C=O)OC=C1 AMY22079 [0,2,0,0,0,0|0,0,0]=2 911 B9R1.14 N#CC1=C(C=O)NC=C1 AMY16252 [0,2,0,0,0,0|1,0,0]=3 912 B9R1.14 O=CC1=C(C=O)SC=C1 AMY19118 [0,2,0,0,0,0|0,1,0]=3 913 B9R1.27 CC1=C(C=O)N(C)N=C1 AMY33241 [0,2,0,0,0,0|2,0,0]=4 914 B9R1.27 CN1N=CC(Br)=C1C=O AMY32901 [0,2,0,0,0,0|2,0,0]=4 915 B7R1.3 BrC1=CN=CC=C1 AM20061386 [0,0,1,1,0,0|2,0,0]=4 916 B7R1.3 CC1=CC=CC=C1 AMY3818 [0,0,1,1,0,0|2,0,0]=4 917 B7R1.3 CC1=CC=CN=C1 AM81278 [0,0,1,1,0,0|2,0,0]=4 918 B7R1.3 ClC1=CC=CC=C1 AMY40791 [0,0,1,1,0,0|2,0,0]=4 919 B7R1.3 ClC1=CN=CC=C1 AM81305 [0,0,1,1,0,0|2,0,0]=4 920 B7R1.3 FC1=CN=CC=C1 AM20051123 [0,0,1,1,0,0|2,0,0]=4 921 B7R1.3 IC1=CC=CC=C1 AMY10020 [0,0,1,1,0,0|2,0,0]=4 922 B7R1.3 IC1=CN=CC=C1 AM84339 [0,0,1,1,0,0|2,0,0]=4 923 B7R1.3 NC1=CC=CC=C1 AMY11081 [0,0,1,1,0,0|2,0,0]=4 924 B7R1.3 NC1=CC=CN=C1 AM20051207 [0,0,1,1,0,0|2,0,0]=4 925 B7R1.3 OC1=CN=CC=C1 AM20050659 [0,0,1,1,0,0|1,0,0]=3 926 B7R1.3 OC1=CN=CN=C1 AM803608 [0,0,1,1,0,0|2,0,0]=4 927 B7R1.3 OC1=CN=NC=C1 AMY3028 [0,0,1,1,0,0|2,0,0]=4 928 B7R1.3 OC1=NC=CC=C1 AM20061675 [0,0,1,1,0,0|2,0,0]=4 929 B7R1.3 OC1=NC=CN=C1 AM20070375 [0,0,1,1,0,0|2,0,0]=4 930 B7R1.3 [SiH3]C1=CC=CC=C1 AM20041020 [0,0,1,1,0,0|2,0,0]=4 931 B7R1.24 C1=CC=CCC=C1 AMY17966 [0,0,1,1,0,0|2,0,0]=4 932 B9R2.3 C1=CC2=C(C=CS2)S1 AM20090288 [0,1,0,1,0,0|0,2,0]=4 933 B5R1.2 O=C1CCO1 AM20020040 [1,0,0,0,1,0|0,0,2]=4