0 B6R1.2 BrC1=CNC=N1 Z1213725191 [0,0,0,0,0,0|1,0,0]=1 1 B6R1.2 C=C1CCNC1 Z3019986853 [0,0,0,0,0,0|1,0,3]=4 2 B6R1.2 C=C1CNOC1 Z3037884222 [0,0,0,0,0,0|2,0,2]=4 3 B6R1.2 CC1=CC=CN1 Z594218440 [0,0,0,0,0,0|1,0,1]=2 4 B6R1.2 CC1=CC=CO1 Z104472456 [0,0,0,0,0,0|2,0,0]=2 5 B6R1.2 CC1=CCNC1 Z1203734447 [0,0,0,0,0,0|1,0,2]=3 6 B6R1.2 CC1=CN=CN1 Z1945707502 [0,0,0,0,0,0|0,0,2]=2 7 B6R1.2 CC1=CN=CO1 Z1198180653 [0,0,0,0,0,0|1,0,1]=2 8 B6R1.2 CC1=CNC=C1 Z1203730789 [0,0,0,0,0,0|1,0,0]=1 9 B6R1.2 CC1=CNN=C1 Z600419582 [0,0,0,0,0,0|2,0,0]=2 10 B6R1.2 CC1=CNN=N1 Z1255358215 [0,0,0,0,0,0|1,0,0]=1 11 B6R1.2 CC1=COC=N1 Z1198313432 [0,0,0,0,0,0|1,0,0]=1 12 B6R1.2 CC1=NC=CN1 Z104494990 [0,0,0,0,0,0|2,0,0]=2 13 B6R1.2 CC1=NCCN1 Z204020260 [0,0,0,0,0,0|2,0,1]=3 14 B6R1.2 CC1=NCCS1 Z104480256 [0,0,0,0,0,0|2,0,1]=3 15 B6R1.2 CC1=NNC=C1 Z450469310 [0,0,0,0,0,0|2,0,0]=2 16 B6R1.2 CC1=NNC=N1 Z939944658 [0,0,0,0,0,0|1,0,0]=1 17 B6R1.2 CC1CCNC1 Z729771722 [0,0,0,0,0,0|1,0,3]=4 18 B6R1.2 CC1CNNC1 Z4953319766 [0,0,0,0,0,0|2,0,2]=4 19 B6R1.2 CN1C=CC=C1 Z57127895 [0,0,0,0,0,0|3,0,0]=3 20 B6R1.2 CN1C=CC=N1 Z336081430 [0,0,0,0,0,0|2,0,0]=2 21 B6R1.2 CN1C=CN=C1 Z104506032 [0,0,0,0,0,0|2,0,1]=3 22 B6R1.2 CN1C=CN=N1 Z1198221873 [0,0,0,0,0,0|3,0,0]=3 23 B6R1.2 CN1C=NC=N1 Z237493308 [0,0,0,0,0,0|1,0,1]=2 24 B6R1.2 CN1C=NN=C1 Z2216303087 [0,0,0,0,0,0|3,0,1]=4 25 B6R1.2 CN1C=NN=N1 Z1198150919 [0,0,0,0,0,0|2,0,1]=3 26 B6R1.2 ClC1=CNN=C1 Z275169786 [0,0,0,0,0,0|3,0,0]=3 27 B6R1.2 ClC1=NC=NN1 Z56788868 [0,0,0,0,0,0|2,0,1]=3 28 B6R1.2 ClC1=NNC=C1 Z1255493581 [0,0,0,0,0,0|3,0,0]=3 29 B6R1.2 IC1=CNN=C1 Z1203162050 [0,0,0,0,0,0|3,0,0]=3 30 B6R1.2 NC1=CC=NO1 Z415654518 [0,0,0,0,0,0|3,0,1]=4 31 B6R1.2 NC1=CC=NS1 Z2568737642 [0,0,0,0,0,0|3,0,1]=4 32 B6R1.2 NC1=CN=NS1 Z1116303505 [0,0,0,0,0,0|3,0,1]=4 33 B6R1.2 NC1=CNC=N1 Z3241270014 [0,0,0,0,0,0|1,0,0]=1 34 B6R1.2 NC1=CNN=N1 Z1964347651 [0,0,0,0,0,0|2,0,0]=2 35 B6R1.2 NC1=CSC=C1 Z1962138158 [0,0,0,0,0,0|3,0,0]=3 36 B6R1.2 NC1=CSN=C1 Z2467685283 [0,0,0,0,0,0|3,0,1]=4 37 B6R1.2 NC1=CSN=N1 Z1868316819 [0,0,0,0,0,0|3,0,0]=3 38 B6R1.2 NC1=NC=CN1 Z1262237195 [0,0,0,0,0,0|3,0,0]=3 39 B6R1.2 NC1=NC=CO1 Z939904646 [0,0,0,0,0,0|3,0,0]=3 40 B6R1.2 NC1=NC=CS1 Z104472798 [0,0,0,0,0,0|3,0,0]=3 41 B6R1.2 NC1=NC=NS1 Z1827897976 [0,0,0,0,0,0|2,0,1]=3 42 B6R1.2 NC1=NCCO1 Z336087916 [0,0,0,0,0,0|3,0,1]=4 43 B6R1.2 NC1=NN=CN1 Z56866006 [0,0,0,0,0,0|2,0,2]=4 44 B6R1.2 NC1=NN=CO1 Z277559304 [0,0,0,0,0,0|3,0,1]=4 45 B6R1.2 NC1=NN=CS1 Z56899142 [0,0,0,0,0,0|3,0,1]=4 46 B6R1.2 NC1=NN=NN1 Z1250100717 [0,0,0,0,0,0|3,0,1]=4 47 B6R1.2 NC1=NN=NS1 Z57087680 [0,0,0,0,0,0|3,0,1]=4 48 B6R1.2 NC1=NNC=C1 Z240126818 [0,0,0,0,0,0|3,0,0]=3 49 B6R1.2 NC1=NNCC1 Z1569708704 [0,0,0,0,0,0|3,0,1]=4 50 B6R1.2 NC1=NON=C1 Z1203638167 [0,0,0,0,0,0|2,0,1]=3 51 B6R1.2 NC1=NSN=C1 Z2065788230 [0,0,0,0,0,0|2,0,1]=3 52 B6R1.2 O=C1C=CCO1 Z1219048777 [0,0,0,0,0,0|3,0,1]=4 53 B6R1.2 O=C1C=CNN1 Z1198154338 [0,0,0,0,0,0|3,0,0]=3 54 B6R1.2 O=C1C=CSN1 Z1741980421 [0,0,0,0,0,0|3,0,1]=4 55 B6R1.2 O=C1CCNC1 Z1741976513 [0,0,0,0,0,0|2,0,2]=4 56 B6R1.2 O=C1CCNN1 Z2935001239 [0,0,0,0,0,0|3,0,1]=4 57 B6R1.2 O=C1NC=CN1 Z1198148260 [0,0,0,0,0,0|3,0,1]=4 58 B6R1.2 O=C1NC=CS1 Z445210514 [0,0,0,0,0,0|3,0,1]=4 59 B6R1.2 OC1=NN=CS1 Z1238571564 [0,0,0,0,0,0|3,0,1]=4 60 B6R1.2 OC1=NOC=C1 Z1255501207 [0,0,0,0,0,0|3,0,0]=3 61 B6R1.2 OC1=NSN=C1 Z119989398 [0,0,0,0,0,0|2,0,1]=3 62 B6R1.2 ON1C=CC=N1 Z1198342489 [0,0,0,0,0,0|3,0,0]=3 63 B6R1.2 SC1=NC=CN1 Z1198723329 [0,0,0,0,0,0|3,0,0]=3 64 B6R1.2 SC1=NC=NN1 Z56871783 [0,0,0,0,0,0|2,0,1]=3 65 B6R1.2 SC1=NCCN1 Z104497392 [0,0,0,0,0,0|3,0,1]=4 66 B6R1.2 SC1=NN=CS1 Z104503476 [0,0,0,0,0,0|3,0,1]=4 67 B6R1.2 [S-]C1=CN=NS1 Z1198153122 [0,0,0,0,0,0|3,0,1]=4 68 B5R1.1 C1=CCNC1 Z2306624771 [1,0,0,0,0,0|1,0,2]=4 69 B5R1.1 C1=CNC=C1 Z104479036 [1,0,0,0,0,0|1,0,0]=2 70 B5R1.1 C1=CNC=N1 Z104472692 [1,0,0,0,0,0|0,0,0]=1 71 B5R1.1 C1=CNN=C1 Z104507728 [1,0,0,0,0,0|2,0,0]=3 72 B5R1.1 C1=CNN=N1 Z237528494 [1,0,0,0,0,0|1,0,0]=2 73 B5R1.1 C1=NN=CN1 Z104479156 [1,0,0,0,0,0|1,0,0]=2 74 B5R1.1 C1=NN=CS1 Z1198156558 [1,0,0,0,0,0|2,0,0]=3 75 B7R1.1 C#CC1=NC=CS1 Z1255400696 [0,1,0,0,0,0|2,0,1]=4 76 B7R1.1 C#CC1=NNC=C1 Z1868316810 [0,1,0,0,0,0|2,0,1]=4 77 B7R1.1 CCC1=CC=CO1 Z640169748 [0,1,0,0,0,0|2,0,0]=3 78 B7R1.1 CCC1=CNC=N1 Z1203731354 [0,1,0,0,0,0|0,0,0]=1 79 B7R1.1 CCC1=CNN=C1 Z1139192482 [0,1,0,0,0,0|2,0,0]=3 80 B7R1.1 CCC1=NC=CN1 Z803154382 [0,1,0,0,0,0|2,0,0]=3 81 B7R1.1 CCC1=NN=CN1 Z2065464313 [0,1,0,0,0,0|1,0,2]=4 82 B7R1.1 CCC1=NN=NN1 Z335291070 [0,1,0,0,0,0|2,0,1]=4 83 B7R1.1 CCC1=NNC=C1 Z1238571110 [0,1,0,0,0,0|2,0,0]=3 84 B7R1.1 CCN1C=CC=N1 Z600618624 [0,1,0,0,0,0|2,0,0]=3 85 B7R1.1 CCN1C=CN=C1 Z286789018 [0,1,0,0,0,0|2,0,1]=4 86 B7R1.1 CCN1C=CN=N1 Z4497103939 [0,1,0,0,0,0|3,0,0]=4 87 B7R1.1 CNC1=CNN=C1 Z1313483441 [0,1,0,0,0,0|2,0,0]=3 88 B7R1.1 CNC1=CNN=N1 Z5069198351 [0,1,0,0,0,0|1,0,0]=2 89 B7R1.1 CNC1=NC=CS1 Z336483296 [0,1,0,0,0,0|2,0,0]=3 90 B7R1.1 CNC1=NCCN1 Z3072981652 [0,1,0,0,0,0|2,0,1]=4 91 B7R1.1 CNC1=NCCS1 Z744843656 [0,1,0,0,0,0|2,0,1]=4 92 B7R1.1 CNC1=NN=CO1 Z235540568 [0,1,0,0,0,0|2,0,1]=4 93 B7R1.1 CNC1=NN=CS1 Z1082870996 [0,1,0,0,0,0|2,0,1]=4 94 B7R1.1 CNC1=NN=NN1 Z2572821634 [0,1,0,0,0,0|2,0,1]=4 95 B7R1.1 CNC1=NOC=C1 Z2489381644 [0,1,0,0,0,0|2,0,0]=3 96 B7R1.1 COC1=CNN=C1 Z2525138345 [0,1,0,0,0,0|2,0,0]=3 97 B7R1.1 COC1=NCCC1 Z147641734 [0,1,0,0,0,0|1,0,2]=4 98 B7R1.1 COC1=NN=CS1 Z1642058386 [0,1,0,0,0,0|2,0,1]=4 99 B7R1.1 COC1=NNC=C1 Z2130657375 [0,1,0,0,0,0|2,0,0]=3 100 B7R1.1 COC1=NSC=C1 Z1198333966 [0,1,0,0,0,0|2,0,0]=3 101 B7R1.1 CSC1=NC=CN1 Z1203730949 [0,1,0,0,0,0|2,0,0]=3 102 B7R1.1 CSC1=NCCN1 Z56790627 [0,1,0,0,0,0|2,0,1]=4 103 B7R1.1 CSC1=NN=NN1 Z821307136 [0,1,0,0,0,0|2,0,1]=4 104 B7R1.1 N#CC1=CC=CS1 Z56946090 [0,1,0,0,0,0|2,0,1]=4 105 B7R1.1 N#CC1=CN=CS1 Z1160900223 [0,1,0,0,0,0|1,0,2]=4 106 B7R1.1 N#CC1=CNC=C1 Z1198155834 [0,1,0,0,0,0|1,0,1]=3 107 B7R1.1 N#CC1=CNN=C1 Z1082448648 [0,1,0,0,0,0|2,0,1]=4 108 B7R1.1 N#CC1=COC=C1 Z1079178908 [0,1,0,0,0,0|2,0,1]=4 109 B7R1.1 N#CC1=COC=N1 Z1143441220 [0,1,0,0,0,0|1,0,1]=3 110 B7R1.1 N#CC1=CSC=C1 Z57900046 [0,1,0,0,0,0|2,0,1]=4 111 B7R1.1 N#CC1=CSC=N1 Z1079456078 [0,1,0,0,0,0|1,0,1]=3 112 B7R1.1 N#CC1=NC=CN1 Z1198180312 [0,1,0,0,0,0|2,0,1]=4 113 B7R1.1 N#CC1=NC=CS1 Z1198221374 [0,1,0,0,0,0|2,0,1]=4 114 B7R1.1 N#CC1=NOC=N1 Z1813175777 [0,1,0,0,0,0|2,0,1]=4 115 B7R1.1 N#CC1=NSC=C1 Z1255498705 [0,1,0,0,0,0|2,0,1]=4 116 B7R1.1 NCC1=CC=CN1 Z976631692 [0,1,0,0,0,0|1,0,1]=3 117 B7R1.1 NCC1=CC=CS1 Z104485908 [0,1,0,0,0,0|2,0,0]=3 118 B7R1.1 NCC1=CC=NO1 Z1964347782 [0,1,0,0,0,0|2,0,1]=4 119 B7R1.1 NCC1=CC=NS1 Z2310716170 [0,1,0,0,0,0|2,0,1]=4 120 B7R1.1 NCC1=CN=CN1 Z1250100778 [0,1,0,0,0,0|0,0,2]=3 121 B7R1.1 NCC1=CNC=C1 Z1203586194 [0,1,0,0,0,0|1,0,0]=2 122 B7R1.1 NCC1=CNN=C1 Z1198394221 [0,1,0,0,0,0|2,0,0]=3 123 B7R1.1 NCC1=CNN=N1 Z2768172060 [0,1,0,0,0,0|1,0,0]=2 124 B7R1.1 NCC1=COC=C1 Z406680098 [0,1,0,0,0,0|2,0,0]=3 125 B7R1.1 NCC1=CSN=C1 Z2310727787 [0,1,0,0,0,0|2,0,1]=4 126 B7R1.1 NCC1=NC=CN1 Z1962341939 [0,1,0,0,0,0|2,0,0]=3 127 B7R1.1 NCC1=NC=CO1 Z4774639311 [0,1,0,0,0,0|2,0,0]=3 128 B7R1.1 NCC1=NC=CS1 Z1198107502 [0,1,0,0,0,0|2,0,0]=3 129 B7R1.1 NCC1=NC=NO1 Z2310727797 [0,1,0,0,0,0|1,0,1]=3 130 B7R1.1 NCC1=NCCN1 Z2714784585 [0,1,0,0,0,0|2,0,1]=4 131 B7R1.1 NCC1=NN=CO1 Z104505014 [0,1,0,0,0,0|2,0,1]=4 132 B7R1.1 NCC1=NN=CS1 Z2738360224 [0,1,0,0,0,0|2,0,1]=4 133 B7R1.1 NCC1=NN=NN1 Z1172068153 [0,1,0,0,0,0|2,0,1]=4 134 B7R1.1 NCC1=NOC=C1 Z802903300 [0,1,0,0,0,0|2,0,0]=3 135 B7R1.1 NCC1=NOC=N1 Z1266854926 [0,1,0,0,0,0|2,0,0]=3 136 B7R1.1 NCC1=NOCC1 Z3217343112 [0,1,0,0,0,0|2,0,1]=4 137 B7R1.1 NCC1=NON=C1 Z2944173400 [0,1,0,0,0,0|1,0,1]=3 138 B7R1.1 O=CC1=CC=CN1 Z104478580 [0,1,0,0,0,0|1,0,2]=4 139 B7R1.1 O=CC1=CC=CO1 Z57161925 [0,1,0,0,0,0|2,0,1]=4 140 B7R1.1 O=CC1=CC=CS1 Z104472120 [0,1,0,0,0,0|2,0,1]=4 141 B7R1.1 O=CC1=CNC=C1 Z1154253206 [0,1,0,0,0,0|1,0,1]=3 142 B7R1.1 O=CC1=CNN=C1 Z275127960 [0,1,0,0,0,0|2,0,1]=4 143 B7R1.1 O=CC1=COC=C1 Z1065630348 [0,1,0,0,0,0|2,0,1]=4 144 B7R1.1 O=CC1=COC=N1 Z1255431640 [0,1,0,0,0,0|1,0,1]=3 145 B7R1.1 O=CC1=CSC=C1 Z57887873 [0,1,0,0,0,0|2,0,1]=4 146 B7R1.1 O=CC1=CSC=N1 Z734052598 [0,1,0,0,0,0|1,0,1]=3 147 B7R1.1 O=CC1=CSN=N1 Z367664148 [0,1,0,0,0,0|2,0,1]=4 148 B7R1.1 O=CC1=NNC=C1 Z234896951 [0,1,0,0,0,0|2,0,1]=4 149 B7R1.1 OCC1=CC=CO1 Z104472794 [0,1,0,0,0,0|2,0,0]=3 150 B7R1.1 OCC1=CC=CS1 Z104478586 [0,1,0,0,0,0|2,0,0]=3 151 B7R1.1 OCC1=CNC=N1 Z234898057 [0,1,0,0,0,0|0,0,0]=1 152 B7R1.1 OCC1=CNN=C1 Z812520032 [0,1,0,0,0,0|2,0,0]=3 153 B7R1.1 OCC1=COC=C1 Z397587426 [0,1,0,0,0,0|2,0,0]=3 154 B7R1.1 OCC1=CSN=N1 Z234897281 [0,1,0,0,0,0|2,0,0]=3 155 B7R1.1 OCC1=NC=CN1 Z825761068 [0,1,0,0,0,0|2,0,0]=3 156 B7R1.1 OCC1=NC=CS1 Z57161013 [0,1,0,0,0,0|2,0,0]=3 157 B7R1.1 OCC1=NN=CN1 Z2574360328 [0,1,0,0,0,0|1,0,2]=4 158 B7R1.1 OCC1=NN=NN1 Z1000189 [0,1,0,0,0,0|2,0,1]=4 159 B7R1.1 OCC1=NOC=C1 Z875021162 [0,1,0,0,0,0|2,0,0]=3 160 B7R1.1 OCN1C=CC=N1 Z1198155714 [0,1,0,0,0,0|2,0,0]=3 161 B7R1.1 OCN1C=NC=N1 Z57071658 [0,1,0,0,0,0|1,0,1]=3 162 B7R1.2 BrC1=CN=C(S1)Br Z1267861077 [0,1,0,0,0,0|2,0,1]=4 163 B7R1.2 BrC1=CSC(=C1)Br Z1245646694 [0,1,0,0,0,0|3,0,0]=4 164 B7R1.2 BrC1=CSC(=N1)Br Z600503298 [0,1,0,0,0,0|2,0,0]=3 165 B7R1.2 BrC1=NNC(=N1)Br Z57069343 [0,1,0,0,0,0|2,0,0]=3 166 B7R1.2 CC1=CC(=NN1)C Z50145988 [0,1,0,0,0,0|2,0,0]=3 167 B7R1.2 CC1=CC(=NO1)N Z104503828 [0,1,0,0,0,0|2,0,1]=4 168 B7R1.2 CC1=CC(=NS1)N Z1198165856 [0,1,0,0,0,0|2,0,1]=4 169 B7R1.2 CC1=CC(=O)NO1 Z56761467 [0,1,0,0,0,0|2,0,0]=3 170 B7R1.2 CC1=CC=C(S1)Br Z1255383262 [0,1,0,0,0,0|2,0,0]=3 171 B7R1.2 CC1=CN=C(N1)O Z2630875693 [0,1,0,0,0,0|0,0,2]=3 172 B7R1.2 CC1=CN=C(O1)N Z994267654 [0,1,0,0,0,0|1,0,1]=3 173 B7R1.2 CC1=CN=C(S1)N Z104500072 [0,1,0,0,0,0|1,0,1]=3 174 B7R1.2 CC1=CNC(=N1)C Z217301646 [0,1,0,0,0,0|0,0,0]=1 175 B7R1.2 CC1=CNC(=N1)N Z2515238565 [0,1,0,0,0,0|0,0,0]=1 176 B7R1.2 CC1=CNC(=N1)S Z1198163268 [0,1,0,0,0,0|0,0,0]=1 177 B7R1.2 CC1=COC(=N1)S Z1416179155 [0,1,0,0,0,0|1,0,0]=2 178 B7R1.2 CC1=CSC(=N1)N Z48847548 [0,1,0,0,0,0|1,0,0]=2 179 B7R1.2 CC1=CSC(=N1)S Z203045926 [0,1,0,0,0,0|1,0,0]=2 180 B7R1.2 CC1=CSC(=O)N1 Z57055803 [0,1,0,0,0,0|1,0,1]=3 181 B7R1.2 CC1=NC(=NO1)N Z1147462977 [0,1,0,0,0,0|1,0,1]=3 182 B7R1.2 CC1=NC(=NS1)N Z1198313987 [0,1,0,0,0,0|1,0,1]=3 183 B7R1.2 CC1=NC(=O)NN1 Z2234631231 [0,1,0,0,0,0|1,0,0]=2 184 B7R1.2 CC1=NC=C(S1)N Z951517342 [0,1,0,0,0,0|2,0,0]=3 185 B7R1.2 CC1=NN=C(N1)N Z951367902 [0,1,0,0,0,0|1,0,2]=4 186 B7R1.2 CC1=NN=C(O1)N Z56957510 [0,1,0,0,0,0|2,0,1]=4 187 B7R1.2 CC1=NN=C(O1)S Z55879328 [0,1,0,0,0,0|2,0,1]=4 188 B7R1.2 CC1=NN=C(S1)Br Z431956576 [0,1,0,0,0,0|2,0,1]=4 189 B7R1.2 CC1=NN=C(S1)N Z56900928 [0,1,0,0,0,0|2,0,1]=4 190 B7R1.2 CC1=NN=C(S1)O Z1238571569 [0,1,0,0,0,0|2,0,1]=4 191 B7R1.2 CC1=NN=C(S1)S Z104485716 [0,1,0,0,0,0|2,0,1]=4 192 B7R1.2 CC1=NNC(=C1)N Z55423088 [0,1,0,0,0,0|2,0,0]=3 193 B7R1.2 CC1=NNC(=N1)C Z57161895 [0,1,0,0,0,0|1,0,0]=2 194 B7R1.2 CC1=NNC(=N1)S Z55982146 [0,1,0,0,0,0|1,0,0]=2 195 B7R1.2 CC1=NNC(=O)C1 Z50145989 [0,1,0,0,0,0|2,0,0]=3 196 B7R1.2 CC1=NNC(=O)O1 Z1198174319 [0,1,0,0,0,0|2,0,0]=3 197 B7R1.2 CC1=NOC(=C1)N Z118429566 [0,1,0,0,0,0|2,0,0]=3 198 B7R1.2 CC1=NOC(=N1)N Z339356524 [0,1,0,0,0,0|2,0,0]=3 199 B7R1.2 CC1=NOC(=N1)O Z1258992446 [0,1,0,0,0,0|2,0,0]=3 200 B7R1.2 CC1=NOC(=N1)S Z1033258624 [0,1,0,0,0,0|2,0,0]=3 201 B7R1.2 CC1=NSC(=C1)N Z204042038 [0,1,0,0,0,0|2,0,0]=3 202 B7R1.2 CC1=NSC(=N1)Cl Z368555490 [0,1,0,0,0,0|2,0,0]=3 203 B7R1.2 CC1=NSC(=N1)N Z431702718 [0,1,0,0,0,0|2,0,0]=3 204 B7R1.2 CC1CC(=O)NN1 Z217165562 [0,1,0,0,0,0|2,0,1]=4 205 B7R1.2 CC1CNC(=N)C1 Z4085233400 [0,1,0,0,0,0|1,0,2]=4 206 B7R1.2 CC1CNC(=O)C1 Z959319678 [0,1,0,0,0,0|1,0,2]=4 207 B7R1.2 CC1CNC(=O)N1 Z1203730895 [0,1,0,0,0,0|0,0,3]=4 208 B7R1.2 CC1CNC(=O)O1 Z1198149952 [0,1,0,0,0,0|1,0,2]=4 209 B7R1.2 CN1C=C(C=N1)Br Z337709426 [0,1,0,0,0,0|2,0,0]=3 210 B7R1.2 CN1C=C(C=N1)I Z957334240 [0,1,0,0,0,0|2,0,0]=3 211 B7R1.2 CN1C=C(C=N1)N Z1741968059 [0,1,0,0,0,0|2,0,0]=3 212 B7R1.2 CN1C=C(C=N1)O Z1258763763 [0,1,0,0,0,0|2,0,0]=3 213 B7R1.2 CN1C=C(N=N1)Br Z1198276396 [0,1,0,0,0,0|2,0,0]=3 214 B7R1.2 CN1C=C(N=N1)N Z2177030666 [0,1,0,0,0,0|2,0,0]=3 215 B7R1.2 CN1C=CC(=N1)O Z1343577415 [0,1,0,0,0,0|2,0,0]=3 216 B7R1.2 CN1C=NC(=C1)N Z2472857442 [0,1,0,0,0,0|1,0,0]=2 217 B7R1.2 CN1C=NC(=N1)N Z57466217 [0,1,0,0,0,0|1,0,1]=3 218 B7R1.2 CN1C=NC(=O)N1 Z1777885320 [0,1,0,0,0,0|2,0,0]=3 219 B7R1.2 CN1CCC(=N1)N Z1582262999 [0,1,0,0,0,0|2,0,1]=4 220 B7R1.2 CN1N=NC(=N1)N Z1198158669 [0,1,0,0,0,0|2,0,1]=4 221 B7R1.2 CN1N=NC(=N1)O Z2299388832 [0,1,0,0,0,0|2,0,1]=4 222 B7R1.2 ClC1=CC=C(S1)Br Z1203161749 [0,1,0,0,0,0|3,0,0]=4 223 B7R1.2 ClC1=NC(=NN1)Br Z1238573163 [0,1,0,0,0,0|2,0,0]=3 224 B7R1.2 NC1=CC(=O)NN1 Z1245635875 [0,1,0,0,0,0|3,0,0]=4 225 B7R1.2 NC1=CCC(=O)N1 Z1203591710 [0,1,0,0,0,0|2,0,1]=4 226 B7R1.2 NC1=CSC(=N1)N Z190661742 [0,1,0,0,0,0|2,0,0]=3 227 B7R1.2 NC1=CSC(=N1)O Z1033300716 [0,1,0,0,0,0|2,0,0]=3 228 B7R1.2 NC1=NC(=O)CS1 Z57104428 [0,1,0,0,0,0|2,0,1]=4 229 B7R1.2 NC1=NC(=S)SS1 Z56761438 [0,1,0,0,0,0|3,0,0]=4 230 B7R1.2 NC1=NC=C(S1)Br Z57032577 [0,1,0,0,0,0|2,0,1]=4 231 B7R1.2 NC1=NC=C(S1)F Z1198184822 [0,1,0,0,0,0|2,0,1]=4 232 B7R1.2 NC1=NNC(=N1)N Z274514098 [0,1,0,0,0,0|2,0,0]=3 233 B7R1.2 NC1=NNC(=N1)S Z56913172 [0,1,0,0,0,0|2,0,0]=3 234 B7R1.2 NC1=NSC(=N1)N Z56755595 [0,1,0,0,0,0|2,0,1]=4 235 B7R1.2 O=C1C=CC(=O)C1 Z1083219844 [0,1,0,0,0,0|3,0,0]=4 236 B7R1.2 O=C1C=CC(=O)N1 Z223655288 [0,1,0,0,0,0|2,0,1]=4 237 B7R1.2 O=C1CC(=O)NN1 Z1278925673 [0,1,0,0,0,0|3,0,0]=4 238 B7R1.2 O=C1CNC(=O)N1 Z57131035 [0,1,0,0,0,0|1,0,2]=4 239 B7R1.2 O=C1CNC(=S)N1 Z56900799 [0,1,0,0,0,0|1,0,2]=4 240 B7R1.2 O=C1N=C(NN1)S Z1723849188 [0,1,0,0,0,0|2,0,0]=3 241 B7R1.2 O=C1NC=C(S1)Cl Z1270529019 [0,1,0,0,0,0|2,0,0]=3 242 B7R1.2 O=C1NNC(=O)N1 Z1255461133 [0,1,0,0,0,0|2,0,1]=4 243 B7R1.4 CC1=C(C=CS1)Br Z1201624904 [0,1,0,0,0,0|2,0,0]=3 244 B7R1.4 CC1=C(C=NN1)Cl Z1507502582 [0,1,0,0,0,0|2,0,1]=4 245 B7R1.4 CC1=C(C=NO1)I Z1269175158 [0,1,0,0,0,0|2,0,1]=4 246 B7R1.4 CC1=C(C=NO1)N Z1465461252 [0,1,0,0,0,0|2,0,1]=4 247 B7R1.4 CC1=C(CNC1)C Z1203817906 [0,1,0,0,0,0|1,0,2]=4 248 B7R1.4 CC1=C(NN=N1)N Z2527856121 [0,1,0,0,0,0|1,0,0]=2 249 B7R1.4 CC1=C(ON=C1)N Z815305382 [0,1,0,0,0,0|2,0,1]=4 250 B7R1.4 CC1=C(SC=N1)N Z1815155510 [0,1,0,0,0,0|1,0,0]=2 251 B7R1.4 CC1=C(SN=C1)N Z3716437679 [0,1,0,0,0,0|2,0,1]=4 252 B7R1.4 CC1=CC=NN1C Z826535916 [0,1,0,0,0,0|2,0,0]=3 253 B7R1.4 CC1=CNC=C1C Z1198162792 [0,1,0,0,0,0|1,0,0]=2 254 B7R1.4 CC1=CON=C1N Z995041844 [0,1,0,0,0,0|2,0,1]=4 255 B7R1.4 CC1=CSC=C1N Z1492796718 [0,1,0,0,0,0|2,0,0]=3 256 B7R1.4 CC1=NN=CN1C Z422646574 [0,1,0,0,0,0|1,0,2]=4 257 B7R1.4 CC1=NNC=C1N Z600615694 [0,1,0,0,0,0|2,0,0]=3 258 B7R1.4 CC1=NOC=C1N Z2466617876 [0,1,0,0,0,0|2,0,0]=3 259 B7R1.4 CC1=NON=C1N Z57948408 [0,1,0,0,0,0|1,0,1]=3 260 B7R1.4 CC1=NSC=C1N Z2737427927 [0,1,0,0,0,0|2,0,0]=3 261 B7R1.4 CC1CCNC1=O Z1198147219 [0,1,0,0,0,0|1,0,2]=4 262 B7R1.4 CN1C=CN=C1Br Z959380970 [0,1,0,0,0,0|2,0,1]=4 263 B7R1.4 CN1C=CN=C1N Z2309759326 [0,1,0,0,0,0|2,0,1]=4 264 B7R1.4 CN1C=CN=C1S Z57901905 [0,1,0,0,0,0|2,0,1]=4 265 B7R1.4 CN1C=CNC1=O Z1198329852 [0,1,0,0,0,0|2,0,0]=3 266 B7R1.4 CN1C=COC1=O Z2732441923 [0,1,0,0,0,0|3,0,0]=4 267 B7R1.4 CN1C=NC=C1Cl Z168874650 [0,1,0,0,0,0|1,0,2]=4 268 B7R1.4 CN1C=NNC1=O Z1526503443 [0,1,0,0,0,0|3,0,0]=4 269 B7R1.4 CN1CCNC1=O Z336079928 [0,1,0,0,0,0|2,0,1]=4 270 B7R1.4 CN1N=CC=C1N Z415654476 [0,1,0,0,0,0|2,0,0]=3 271 B7R1.4 CN1N=CN=C1N Z56757681 [0,1,0,0,0,0|1,0,1]=3 272 B7R1.4 CN1N=CN=C1S Z1655141058 [0,1,0,0,0,0|1,0,1]=3 273 B7R1.4 CN1N=NC=C1N Z4351247746 [0,1,0,0,0,0|3,0,0]=4 274 B7R1.4 CN1N=NC=C1O Z4561746935 [0,1,0,0,0,0|3,0,0]=4 275 B7R1.4 CN1N=NN=C1Cl Z727906904 [0,1,0,0,0,0|2,0,1]=4 276 B7R1.4 CN1N=NN=C1N Z56791607 [0,1,0,0,0,0|2,0,1]=4 277 B7R1.4 CN1N=NN=C1O Z1492395436 [0,1,0,0,0,0|2,0,1]=4 278 B7R1.4 CN1NC=NC1=O Z1582263737 [0,1,0,0,0,0|2,0,0]=3 279 B7R1.4 CN1NN=NC1=S Z262221718 [0,1,0,0,0,0|3,0,0]=4 280 B7R1.4 CN1SC=CC1=O Z3227502095 [0,1,0,0,0,0|3,0,0]=4 281 B7R1.4 C[N+]1=C(SC=C1)N Z56872230 [0,1,0,0,0,0|3,0,0]=4 282 B7R1.4 ClC1=CSC=C1Cl Z1198181374 [0,1,0,0,0,0|3,0,0]=4 283 B7R1.4 ClC1=NS[S+]=C1Cl Z2027355894 [0,1,0,0,0,0|3,0,0]=4 284 B7R1.4 NC1=C(C=NN1)F Z3489104737 [0,1,0,0,0,0|3,0,0]=4 285 B7R1.4 NC1=CNN=C1N Z802599594 [0,1,0,0,0,0|3,0,0]=4 286 B7R1.4 NC1=CNNC1=O Z2216303144 [0,1,0,0,0,0|3,0,0]=4 287 B7R1.4 NC1=CSC=C1Br Z2235409323 [0,1,0,0,0,0|3,0,0]=4 288 B7R1.4 NC1=NNC=C1Cl Z1741966355 [0,1,0,0,0,0|3,0,0]=4 289 B7R1.4 NC1=NNC=C1I Z1269216483 [0,1,0,0,0,0|3,0,0]=4 290 B7R1.4 OC1=NSC=C1Br Z3243456041 [0,1,0,0,0,0|3,0,0]=4 291 B5R0.1 C/C(=C\C#N)/[O-] Z90662985 [0,0,1,0,0,0|3,0,0]=4 292 B5R0.1 C/C(=N/C#N)/N Z2573128414 [0,0,1,0,0,0|1,0,2]=4 293 B5R0.1 C=C(C)CCN Z1203582475 [0,0,1,0,0,0|1,0,1]=3 294 B5R0.1 CC(=CC#N)C Z851014248 [0,0,1,0,0,0|3,0,0]=4 295 B5R0.1 CC(=CCN)C Z1827897919 [0,0,1,0,0,0|1,0,2]=4 296 B5R0.2 C/C=C/CCN Z1268152372 [0,0,1,0,0,0|1,0,2]=4 297 B5R0.2 C/C=C/OCC Z281777810 [0,0,1,0,0,0|2,0,1]=4 298 B5R0.3 C/N=C(\C)/NC Z1431002714 [0,0,1,0,0,0|2,0,1]=4 299 B7R1.3 BrC1=CN=CN=C1 Z285136922 [0,0,0,0,0,1|1,0,1]=3 300 B7R1.3 BrC1=NC=CC=N1 Z415645012 [0,0,0,0,0,1|2,0,0]=3 301 B7R1.3 BrC1=NC=CN=C1 Z415645016 [0,0,0,0,0,1|1,0,1]=3 302 B7R1.3 BrC1=NN=CC=C1 Z425821176 [0,0,0,0,0,1|2,0,0]=3 303 B7R1.3 CC1=CCCNC1 Z2143573194 [0,0,0,0,0,1|1,0,2]=4 304 B7R1.3 CC1=CN=CC=C1 Z104475010 [0,0,0,0,0,1|1,0,0]=2 305 B7R1.3 CC1=CN=NC=C1 Z1255398931 [0,0,0,0,0,1|1,0,1]=3 306 B7R1.3 CC1=NC=CC=C1 Z104472800 [0,0,0,0,0,1|1,0,0]=2 307 B7R1.3 CC1=NC=CN=C1 Z415628164 [0,0,0,0,0,1|0,0,1]=2 308 B7R1.3 CC1=NN=CC=C1 Z1245648324 [0,0,0,0,0,1|1,0,0]=2 309 B7R1.3 C[N+]1=CC=CC=C1 Z57947843 [0,0,0,0,0,1|3,0,0]=4 310 B7R1.3 ClC1=NC=CC=N1 Z104477694 [0,0,0,0,0,1|2,0,0]=3 311 B7R1.3 ClC1=NC=CN=C1 Z104490192 [0,0,0,0,0,1|1,0,1]=3 312 B7R1.3 ClC1=NC=NC=C1 Z1962223597 [0,0,0,0,0,1|1,0,1]=3 313 B7R1.3 ClC1=NN=CC=C1 Z3225948108 [0,0,0,0,0,1|2,0,0]=3 314 B7R1.3 IC1=CN=CN=C1 Z1259106172 [0,0,0,0,0,1|1,0,1]=3 315 B7R1.3 IC1=NC=CN=C1 Z1235940810 [0,0,0,0,0,1|1,0,1]=3 316 B7R1.3 NC1=CC=CC=C1 Z2301541997 [0,0,0,0,0,1|3,0,0]=4 317 B7R1.3 NC1=CC=NC=C1 Z104495272 [0,0,0,0,0,1|2,0,1]=4 318 B7R1.3 NC1=CN=CC=C1 Z104494800 [0,0,0,0,0,1|2,0,0]=3 319 B7R1.3 NC1=CN=CN=C1 Z800187814 [0,0,0,0,0,1|1,0,1]=3 320 B7R1.3 NC1=NC=CC=C1 Z104472278 [0,0,0,0,0,1|2,0,0]=3 321 B7R1.3 NC1=NC=CC=N1 Z2895177097 [0,0,0,0,0,1|2,0,0]=3 322 B7R1.3 NC1=NC=CN=C1 Z56899063 [0,0,0,0,0,1|1,0,1]=3 323 B7R1.3 NC1=NC=NC=C1 Z3244659415 [0,0,0,0,0,1|1,0,1]=3 324 B7R1.3 NC1=NC=NC=N1 Z1165162993 [0,0,0,0,0,1|1,0,1]=3 325 B7R1.3 NC1=NC=NN=C1 Z1203581736 [0,0,0,0,0,1|1,0,1]=3 326 B7R1.3 NC1=NN=CC=C1 Z991531024 [0,0,0,0,0,1|2,0,0]=3 327 B7R1.3 NC1=NN=CC=N1 Z104477884 [0,0,0,0,0,1|2,0,1]=4 328 B7R1.3 O=C1C=CC=CN1 Z1245646663 [0,0,0,0,0,1|2,0,1]=4 329 B7R1.3 O=C1C=CC=NN1 Z803153778 [0,0,0,0,0,1|2,0,0]=3 330 B7R1.3 O=C1C=COC=C1 Z586248016 [0,0,0,0,0,1|3,0,0]=4 331 B7R1.3 O=C1C=NC=CN1 Z3225868124 [0,0,0,0,0,1|1,0,2]=4 332 B7R1.3 O=C1N=CC=CN1 Z1201023052 [0,0,0,0,0,1|2,0,0]=3 333 B7R1.3 OC1=CC=CC=C1 Z104473830 [0,0,0,0,0,1|3,0,0]=4 334 B7R1.3 OC1=CN=CC=C1 Z104476790 [0,0,0,0,0,1|2,0,0]=3 335 B7R1.3 OC1=CN=CN=C1 Z1116372083 [0,0,0,0,0,1|1,0,1]=3 336 B7R1.3 OC1=CN=NC=C1 Z2235790619 [0,0,0,0,0,1|2,0,1]=4 337 B7R1.3 OC1=NC=NC=C1 Z314605438 [0,0,0,0,0,1|1,0,1]=3 338 B7R1.3 S=C1C=CNC=N1 Z1258992452 [0,0,0,0,0,1|1,0,0]=2 339 B7R1.3 SC1=NC=CC=C1 Z203045372 [0,0,0,0,0,1|2,0,0]=3 340 B7R1.3 SC1=NC=CC=N1 Z87001196 [0,0,0,0,0,1|2,0,0]=3 341 B7R1.3 SC1=NC=CN=C1 Z239089534 [0,0,0,0,0,1|1,0,1]=3 342 B4R0.1 C=C(Br)CN Z600439032 [1,0,1,0,0,0|1,0,1]=4 343 B4R0.1 C=CC(=C)C Z104474660 [1,0,1,0,0,0|1,0,0]=3 344 B4R0.1 C=CC(=O)O Z57127944 [1,0,1,0,0,0|2,0,0]=4 345 B4R0.1 C=CC(C)N Z1446855743 [1,0,1,0,0,0|0,0,2]=4 346 B4R0.1 CC(=O)C=O Z104495190 [1,0,1,0,0,0|2,0,0]=4 347 B4R0.1 CC(=O)CN Z1262398366 [1,0,1,0,0,0|1,0,1]=4 348 B4R0.1 CC(=O)NN Z58981787 [1,0,1,0,0,0|1,0,1]=4 349 B4R0.1 CC(=O)NO Z59181917 [1,0,1,0,0,0|2,0,0]=4 350 B4R0.1 CNC(=N)C Z2146515751 [1,0,1,0,0,0|0,0,1]=3 351 B4R0.1 CNC(=O)C Z32016274 [1,0,1,0,0,0|1,0,1]=4 352 B4R0.1 N=C(N)CN Z3798800325 [1,0,1,0,0,0|1,0,1]=4 353 B4R0.1 N=C(N)NN Z1259217988 [1,0,1,0,0,0|2,0,0]=4 354 B6R0.2 C=C(C)CC(=O)O Z295890066 [0,1,1,0,0,0|2,0,0]=4 355 B6R0.2 CC(=CC(=O)N)C Z33546934 [0,1,1,0,0,0|1,0,1]=4 356 B6R0.2 CC(=O)/C=C(/C)\N Z56858245 [0,1,1,0,0,0|2,0,0]=4 357 B6R0.2 CC(=O)NC(=N)N Z1203578060 [0,1,1,0,0,0|1,0,1]=4 358 B6R0.2 CC(=O)NC(=O)N Z104476284 [0,1,1,0,0,0|1,0,1]=4 359 B8R1.2 C#CC1=CN=CN=C1 Z1080385536 [0,1,0,0,0,1|0,0,2]=4 360 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [0,1,0,0,0,1|1,0,1]=4 361 B8R1.2 CCC1=CC=CC=C1 Z104473632 [0,1,0,0,0,1|2,0,0]=4 362 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [0,1,0,0,0,1|1,0,1]=4 363 B8R1.2 CCC1=CN=CC=C1 Z104476778 [0,1,0,0,0,1|1,0,0]=3 364 B8R1.2 CCC1=NC=CC=C1 Z113558650 [0,1,0,0,0,1|1,0,0]=3 365 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [0,1,0,0,0,1|1,0,0]=3 366 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [0,1,0,0,0,1|0,0,1]=3 367 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [0,1,0,0,0,1|1,0,0]=3 368 B8R1.2 CNC1=CC=CC=C1 Z104472478 [0,1,0,0,0,1|2,0,0]=4 369 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [0,1,0,0,0,1|1,0,0]=3 370 B8R1.2 CNC1=NC=CC=N1 Z54628578 [0,1,0,0,0,1|1,0,0]=3 371 B8R1.2 CNC1=NC=NC=C1 Z800212728 [0,1,0,0,0,1|0,0,1]=3 372 B8R1.2 CNC1=NN=CC=C1 Z991530894 [0,1,0,0,0,1|1,0,0]=3 373 B8R1.2 CNC1=NN=CC=N1 Z1198323671 [0,1,0,0,0,1|1,0,1]=4 374 B8R1.2 COC1=CC=CC=C1 Z53833865 [0,1,0,0,0,1|2,0,0]=4 375 B8R1.2 CSC1=CC=NC=C1 Z1376456468 [0,1,0,0,0,1|1,0,1]=4 376 B8R1.2 CSC1=NC=CN=C1 Z1203162104 [0,1,0,0,0,1|0,0,1]=3 377 B8R1.2 N#CC1=CN=CC=C1 Z57899719 [0,1,0,0,0,1|1,0,1]=4 378 B8R1.2 N#CC1=CN=CN=C1 Z1201619938 [0,1,0,0,0,1|0,0,2]=4 379 B8R1.2 N#CC1=NC=CC=N1 Z441820390 [0,1,0,0,0,1|1,0,1]=4 380 B8R1.2 N#CC1=NC=CN=C1 Z448103898 [0,1,0,0,0,1|0,0,2]=4 381 B8R1.2 N#CC1=NC=NC=C1 Z1116387809 [0,1,0,0,0,1|0,0,2]=4 382 B8R1.2 N#CC1=NN=CC=C1 Z1198236174 [0,1,0,0,0,1|1,0,1]=4 383 B8R1.2 NCC1=CC=CC=C1 Z54748260 [0,1,0,0,0,1|2,0,0]=4 384 B8R1.2 NCC1=CC=NC=C1 Z104474354 [0,1,0,0,0,1|1,0,1]=4 385 B8R1.2 NCC1=CN=CC=C1 Z104474366 [0,1,0,0,0,1|1,0,0]=3 386 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [0,1,0,0,0,1|0,0,1]=3 387 B8R1.2 NCC1=NC=CC=C1 Z104474352 [0,1,0,0,0,1|1,0,0]=3 388 B8R1.2 NCC1=NC=CC=N1 Z1463350843 [0,1,0,0,0,1|1,0,0]=3 389 B8R1.2 NCC1=NC=CN=C1 Z241059702 [0,1,0,0,0,1|0,0,1]=3 390 B8R1.2 NCC1=NC=NC=C1 Z254526552 [0,1,0,0,0,1|0,0,1]=3 391 B8R1.2 NCC1=NN=CC=C1 Z1198165902 [0,1,0,0,0,1|1,0,0]=3 392 B8R1.2 NNC1=NC=CC=C1 Z56887722 [0,1,0,0,0,1|2,0,0]=4 393 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [0,1,0,0,0,1|1,0,1]=4 394 B8R1.2 O=CC1=CN=CN=C1 Z1013450426 [0,1,0,0,0,1|0,0,2]=4 395 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [0,1,0,0,0,1|1,0,1]=4 396 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [0,1,0,0,0,1|0,0,2]=4 397 B8R1.2 O=CC1=NN=CC=C1 Z1198165301 [0,1,0,0,0,1|1,0,1]=4 398 B8R1.2 OCC1=CC=CC=C1 Z104476418 [0,1,0,0,0,1|2,0,0]=4 399 B8R1.2 OCC1=CC=NC=C1 Z335244866 [0,1,0,0,0,1|1,0,1]=4 400 B8R1.2 OCC1=CCNCC1 Z2310702179 [0,1,0,0,0,1|1,0,1]=4 401 B8R1.2 OCC1=CN=CC=C1 Z104495622 [0,1,0,0,0,1|1,0,0]=3 402 B8R1.2 OCC1=NC=CC=C1 Z57921252 [0,1,0,0,0,1|1,0,0]=3 403 B8R1.3 BrC1=CN=C(C=C1)I Z1269172302 [0,1,0,0,0,1|2,0,0]=4 404 B8R1.3 BrC1=CN=C(N=C1)I Z1192044953 [0,1,0,0,0,1|1,0,1]=4 405 B8R1.3 CC1=CC=C(C=C1)C Z199056432 [0,1,0,0,0,1|2,0,0]=4 406 B8R1.3 CC1=CC=C(C=C1)Cl Z56924546 [0,1,0,0,0,1|2,0,0]=4 407 B8R1.3 CC1=CC=C(C=C1)F Z104473648 [0,1,0,0,0,1|2,0,0]=4 408 B8R1.3 CC1=CC=C(C=C1)N Z57127875 [0,1,0,0,0,1|2,0,0]=4 409 B8R1.3 CC1=CC=C(C=C1)O Z104473818 [0,1,0,0,0,1|2,0,0]=4 410 B8R1.3 CC1=CN=C(C=C1)Br Z415645054 [0,1,0,0,0,1|1,0,0]=3 411 B8R1.3 CC1=CN=C(C=C1)N Z104475374 [0,1,0,0,0,1|1,0,0]=3 412 B8R1.3 CC1=CN=C(C=C1)O Z1255523405 [0,1,0,0,0,1|1,0,0]=3 413 B8R1.3 CC1=CN=C(C=C1)S Z271138132 [0,1,0,0,0,1|1,0,0]=3 414 B8R1.3 CC1=CN=C(N=C1)Br Z1098236936 [0,1,0,0,0,1|0,0,1]=3 415 B8R1.3 CC1=CN=C(N=C1)Cl Z1098236276 [0,1,0,0,0,1|0,0,1]=3 416 B8R1.3 CC1=CN=C(N=C1)F Z1198266630 [0,1,0,0,0,1|0,0,1]=3 417 B8R1.3 CC1=CN=C(N=C1)N Z801565598 [0,1,0,0,0,1|0,0,1]=3 418 B8R1.3 CC1=CN=C(N=C1)S Z1868163321 [0,1,0,0,0,1|0,0,1]=3 419 B8R1.3 CC1=CNC(=O)N=C1 Z1098236277 [0,1,0,0,0,1|0,0,0]=2 420 B8R1.3 CC1=NC=C(C=C1)N Z425834586 [0,1,0,0,0,1|1,0,0]=3 421 B8R1.3 CC1=NC=C(C=C1)O Z838078132 [0,1,0,0,0,1|1,0,0]=3 422 B8R1.3 CC1=NC=C(N=C1)Br Z1198181968 [0,1,0,0,0,1|0,0,1]=3 423 B8R1.3 CC1=NC=C(N=C1)Cl Z1198149378 [0,1,0,0,0,1|0,0,1]=3 424 B8R1.3 CC1=NC=C(N=C1)N Z1198177429 [0,1,0,0,0,1|0,0,1]=3 425 B8R1.3 CC1=NN=C(C=C1)Br Z802822146 [0,1,0,0,0,1|1,0,0]=3 426 B8R1.3 CC1=NN=C(C=C1)Cl Z432063474 [0,1,0,0,0,1|1,0,0]=3 427 B8R1.3 CC1=NN=C(C=C1)F Z1251352426 [0,1,0,0,0,1|1,0,0]=3 428 B8R1.3 CC1=NN=C(C=C1)I Z1209436744 [0,1,0,0,0,1|1,0,0]=3 429 B8R1.3 CC1=NN=C(N=C1)N Z1203578846 [0,1,0,0,0,1|0,0,1]=3 430 B8R1.3 CC1=NNC(=O)C=C1 Z1201023044 [0,1,0,0,0,1|1,0,0]=3 431 B8R1.3 CC1=NNC(=O)CC1 Z49527484 [0,1,0,0,0,1|1,0,1]=4 432 B8R1.3 CC1CN=C(NC1)N Z1203586632 [0,1,0,0,0,1|0,0,2]=4 433 B8R1.3 CN1CN=C(NC1)S Z57980315 [0,1,0,0,0,1|1,0,1]=4 434 B8R1.3 ClC1=CN=C(C=C1)Br Z415645024 [0,1,0,0,0,1|2,0,0]=4 435 B8R1.3 ClC1=CN=C(C=N1)Cl Z1198164590 [0,1,0,0,0,1|1,0,1]=4 436 B8R1.3 ClC1=CN=C(N=C1)Br Z1198342885 [0,1,0,0,0,1|1,0,1]=4 437 B8R1.3 ClC1=CN=C(N=C1)Cl Z1198154633 [0,1,0,0,0,1|1,0,1]=4 438 B8R1.3 ClC1=NC=C(C=C1)Br Z239604476 [0,1,0,0,0,1|2,0,0]=4 439 B8R1.3 ClC1=NC=C(C=N1)Br Z1079244864 [0,1,0,0,0,1|1,0,1]=4 440 B8R1.3 ClC1=NC=C(C=N1)I Z1124375877 [0,1,0,0,0,1|1,0,1]=4 441 B8R1.3 ClC1=NC=C(N=C1)Br Z1198179757 [0,1,0,0,0,1|1,0,1]=4 442 B8R1.3 ClC1=NC=C(N=C1)I Z1269194601 [0,1,0,0,0,1|1,0,1]=4 443 B8R1.3 ClC1=NN=C(C=C1)Br Z1198233188 [0,1,0,0,0,1|2,0,0]=4 444 B8R1.3 ClC1=NN=C(C=C1)Cl Z57033933 [0,1,0,0,0,1|2,0,0]=4 445 B8R1.3 ClC1=NN=C(C=C1)I Z1269245018 [0,1,0,0,0,1|2,0,0]=4 446 B8R1.3 FC1=CN=C(C=C1)Cl Z1238544557 [0,1,0,0,0,1|2,0,0]=4 447 B8R1.3 FC1=CN=C(N=C1)Cl Z1255465697 [0,1,0,0,0,1|1,0,1]=4 448 B8R1.3 FC1=NC=C(C=C1)Br Z977035742 [0,1,0,0,0,1|2,0,0]=4 449 B8R1.3 FC1=NC=C(C=N1)Cl Z1255462882 [0,1,0,0,0,1|1,0,1]=4 450 B8R1.3 FC1=NC=C(N=C1)Cl Z1198220735 [0,1,0,0,0,1|1,0,1]=4 451 B8R1.3 FC1=NN=C(C=C1)Cl Z1618110321 [0,1,0,0,0,1|2,0,0]=4 452 B8R1.3 NC1=CN=C(C=C1)Cl Z335436282 [0,1,0,0,0,1|2,0,0]=4 453 B8R1.3 NC1=CN=C(C=C1)I Z56788762 [0,1,0,0,0,1|2,0,0]=4 454 B8R1.3 NC1=CN=C(C=C1)N Z385438796 [0,1,0,0,0,1|2,0,0]=4 455 B8R1.3 NC1=CN=C(C=C1)O Z385458150 [0,1,0,0,0,1|2,0,0]=4 456 B8R1.3 NC1=CN=C(N=C1)N Z362768106 [0,1,0,0,0,1|1,0,1]=4 457 B8R1.3 NC1=NC=C(C=C1)Br Z57073814 [0,1,0,0,0,1|2,0,0]=4 458 B8R1.3 NC1=NC=C(C=C1)Cl Z104475596 [0,1,0,0,0,1|2,0,0]=4 459 B8R1.3 NC1=NC=C(C=C1)F Z223120142 [0,1,0,0,0,1|2,0,0]=4 460 B8R1.3 NC1=NC=C(C=N1)Br Z729558264 [0,1,0,0,0,1|1,0,1]=4 461 B8R1.3 NC1=NC=C(C=N1)F Z1203579458 [0,1,0,0,0,1|1,0,1]=4 462 B8R1.3 NC1=NC=C(C=N1)I Z1269125822 [0,1,0,0,0,1|1,0,1]=4 463 B8R1.3 NC1=NC=C(C=N1)O Z1198175903 [0,1,0,0,0,1|1,0,1]=4 464 B8R1.3 NC1=NN=C(C=C1)Cl Z56973924 [0,1,0,0,0,1|2,0,0]=4 465 B8R1.3 NC1=NNC(=O)C=C1 Z1723418911 [0,1,0,0,0,1|2,0,0]=4 466 B8R1.3 O=C1C=CC(=CN1)Br Z271004874 [0,1,0,0,0,1|2,0,0]=4 467 B8R1.3 O=C1N=CC(=CN1)I Z2471547918 [0,1,0,0,0,1|1,0,0]=3 468 B8R1.3 OC1=CN=C(C=C1)Br Z1201622821 [0,1,0,0,0,1|2,0,0]=4 469 B8R1.3 OC1=CN=C(C=C1)I Z1269183606 [0,1,0,0,0,1|2,0,0]=4 470 B8R1.3 OC1=CN=C(C=C1)O Z1198152559 [0,1,0,0,0,1|2,0,0]=4 471 B8R1.3 OC1=NC=C(C=C1)Cl Z2235409237 [0,1,0,0,0,1|2,0,0]=4 472 B8R1.3 OC1=NC=C(C=C1)F Z594267896 [0,1,0,0,0,1|2,0,0]=4 473 B8R1.3 OC1=NC=C(C=C1)I Z1269227573 [0,1,0,0,0,1|2,0,0]=4 474 B8R1.3 SC1=NC=C(C=C1)Cl Z271138142 [0,1,0,0,0,1|2,0,0]=4 475 B8R1.4 BrC1=CC(=CN=C1)I Z1269188472 [0,1,0,0,0,1|2,0,0]=4 476 B8R1.4 BrC1=CN=CC(=C1)Br Z57070461 [0,1,0,0,0,1|2,0,0]=4 477 B8R1.4 CC1=CC(=CC=C1)F Z104474044 [0,1,0,0,0,1|2,0,0]=4 478 B8R1.4 CC1=CC(=CC=C1)N Z57127904 [0,1,0,0,0,1|2,0,0]=4 479 B8R1.4 CC1=CC(=CC=C1)O Z104473820 [0,1,0,0,0,1|2,0,0]=4 480 B8R1.4 CC1=CC(=CN=C1)Br Z1255461727 [0,1,0,0,0,1|1,0,0]=3 481 B8R1.4 CC1=CC(=NC=C1)Br Z851792570 [0,1,0,0,0,1|1,0,1]=4 482 B8R1.4 CC1=CC(=NC=C1)N Z203045032 [0,1,0,0,0,1|1,0,1]=4 483 B8R1.4 CC1=CC(=NC=C1)S Z851791760 [0,1,0,0,0,1|1,0,1]=4 484 B8R1.4 CC1=CC(=NN=C1)Cl Z1201625142 [0,1,0,0,0,1|1,0,1]=4 485 B8R1.4 CC1=CC(=NN=C1)N Z1198278271 [0,1,0,0,0,1|1,0,1]=4 486 B8R1.4 CC1=CC(=NN=C1)O Z1198278270 [0,1,0,0,0,1|1,0,1]=4 487 B8R1.4 CC1=CC(=O)NC=C1 Z1065655286 [0,1,0,0,0,1|1,0,0]=3 488 B8R1.4 CC1=CC=CC(=C1)C Z199056430 [0,1,0,0,0,1|2,0,0]=4 489 B8R1.4 CC1=CC=CC(=N1)C Z104472820 [0,1,0,0,0,1|1,0,0]=3 490 B8R1.4 CC1=CC=CC(=O)N1 Z600389900 [0,1,0,0,0,1|1,0,1]=4 491 B8R1.4 CC1=NC(=CC=C1)Br Z600403652 [0,1,0,0,0,1|1,0,0]=3 492 B8R1.4 CC1=NC(=CC=C1)N Z104476000 [0,1,0,0,0,1|1,0,0]=3 493 B8R1.4 CC1=NC(=CC=N1)Br Z1013760006 [0,1,0,0,0,1|1,0,0]=3 494 B8R1.4 CC1=NC(=CC=N1)Cl Z445153084 [0,1,0,0,0,1|1,0,0]=3 495 B8R1.4 CC1=NC(=CN=C1)Br Z1255361267 [0,1,0,0,0,1|0,0,1]=3 496 B8R1.4 CC1=NC(=CN=C1)Cl Z1162448376 [0,1,0,0,0,1|0,0,1]=3 497 B8R1.4 CC1=NC(=CN=C1)F Z1862003526 [0,1,0,0,0,1|0,0,1]=3 498 B8R1.4 CC1=NC(=CN=C1)N Z1203578408 [0,1,0,0,0,1|0,0,1]=3 499 B8R1.4 CC1=NC(=N)C=CN1 Z2092177023 [0,1,0,0,0,1|1,0,0]=3 500 B8R1.4 CC1=NC(=NC=C1)Br Z1065587482 [0,1,0,0,0,1|0,0,1]=3 501 B8R1.4 CC1=NC(=NC=C1)Cl Z1065586248 [0,1,0,0,0,1|0,0,1]=3 502 B8R1.4 CC1=NC(=NC=C1)N Z104500640 [0,1,0,0,0,1|0,0,1]=3 503 B8R1.4 CC1=NC(=NC=N1)Cl Z1618143146 [0,1,0,0,0,1|0,0,1]=3 504 B8R1.4 CC1=NC(=NC=N1)N Z1165162631 [0,1,0,0,0,1|0,0,1]=3 505 B8R1.4 CC1=NC(=NN=C1)N Z381019664 [0,1,0,0,0,1|0,0,1]=3 506 B8R1.4 CC1=NC(=O)C=CN1 Z1269638492 [0,1,0,0,0,1|1,0,0]=3 507 B8R1.4 CC1=NC(=O)NC=C1 Z1065584884 [0,1,0,0,0,1|0,0,0]=2 508 B8R1.4 CC1=NC=CC(=C1)[S-] Z3014227847 [0,1,0,0,0,1|1,0,0]=3 509 B8R1.4 CC1=NC=NC(=C1)Br Z787349642 [0,1,0,0,0,1|0,0,1]=3 510 B8R1.4 CC1=NC=NC(=C1)Cl Z787326738 [0,1,0,0,0,1|0,0,1]=3 511 B8R1.4 CC1=NC=NC(=C1)N Z787349196 [0,1,0,0,0,1|0,0,1]=3 512 B8R1.4 CC1=NC=NC(=C1)O Z314661966 [0,1,0,0,0,1|0,0,1]=3 513 B8R1.4 CC1=NN=CC(=C1)N Z2462827969 [0,1,0,0,0,1|1,0,0]=3 514 B8R1.4 ClC1=CC(=NC=N1)Cl Z212050238 [0,1,0,0,0,1|1,0,1]=4 515 B8R1.4 ClC1=CC(=NN=C1)Cl Z1198278268 [0,1,0,0,0,1|2,0,0]=4 516 B8R1.4 ClC1=CN=CC(=N1)Cl Z217291786 [0,1,0,0,0,1|1,0,1]=4 517 B8R1.4 ClC1=NC(=CC=N1)I Z1269134310 [0,1,0,0,0,1|1,0,1]=4 518 B8R1.4 ClC1=NC(=NC=C1)Br Z1201625923 [0,1,0,0,0,1|1,0,1]=4 519 B8R1.4 ClC1=NC(=NC=C1)Cl Z99601188 [0,1,0,0,0,1|1,0,1]=4 520 B8R1.4 ClC1=NC=CC(=C1)Br Z1255461858 [0,1,0,0,0,1|2,0,0]=4 521 B8R1.4 ClC1=NC=NC(=N1)Cl Z1201622881 [0,1,0,0,0,1|1,0,1]=4 522 B8R1.4 FC1=CC(=CN=C1)I Z1269109329 [0,1,0,0,0,1|2,0,0]=4 523 B8R1.4 FC1=CC(=NN=C1)Cl Z4047446131 [0,1,0,0,0,1|2,0,0]=4 524 B8R1.4 FC1=NC(=CN=C1)Cl Z1255444361 [0,1,0,0,0,1|1,0,1]=4 525 B8R1.4 FC1=NC=NC(=C1)Cl Z1201625301 [0,1,0,0,0,1|1,0,1]=4 526 B8R1.4 NC1=CC(=CN=C1)Cl Z2830704581 [0,1,0,0,0,1|2,0,0]=4 527 B8R1.4 NC1=CC(=CN=C1)F Z1201619910 [0,1,0,0,0,1|2,0,0]=4 528 B8R1.4 NC1=CC(=NC=C1)Cl Z217306542 [0,1,0,0,0,1|2,0,0]=4 529 B8R1.4 NC1=CC(=NC=C1)N Z851810344 [0,1,0,0,0,1|2,0,0]=4 530 B8R1.4 NC1=CC(=NC=C1)O Z851811376 [0,1,0,0,0,1|2,0,0]=4 531 B8R1.4 NC1=CC(=NC=N1)N Z314599008 [0,1,0,0,0,1|1,0,1]=4 532 B8R1.4 NC1=CC(=O)NC=N1 Z800191892 [0,1,0,0,0,1|1,0,0]=3 533 B8R1.4 NC1=CC(=O)NN=C1 Z1198330189 [0,1,0,0,0,1|2,0,0]=4 534 B8R1.4 NC1=CC=CC(=N1)N Z104495224 [0,1,0,0,0,1|2,0,0]=4 535 B8R1.4 NC1=CN=CC(=C1)N Z3158827045 [0,1,0,0,0,1|2,0,0]=4 536 B8R1.4 NC1=NC(=CC=C1)Br Z425864750 [0,1,0,0,0,1|2,0,0]=4 537 B8R1.4 NC1=NC(=CN=C1)Cl Z850999210 [0,1,0,0,0,1|1,0,1]=4 538 B8R1.4 NC1=NC(=NC=C1)N Z856211450 [0,1,0,0,0,1|1,0,1]=4 539 B8R1.4 NC1=NC(=NC=C1)O Z203045338 [0,1,0,0,0,1|1,0,1]=4 540 B8R1.4 NC1=NC(=NC=N1)S Z1201620430 [0,1,0,0,0,1|1,0,1]=4 541 B8R1.4 NC1=NC(=O)C=NN1 Z1203579074 [0,1,0,0,0,1|1,0,0]=3 542 B8R1.4 NC1=NC=CC(=C1)F Z2513334082 [0,1,0,0,0,1|2,0,0]=4 543 B8R1.4 NC1=NC=CC(=C1)O Z1198164201 [0,1,0,0,0,1|2,0,0]=4 544 B8R1.4 NC1=NC=CC(=O)N1 Z801295650 [0,1,0,0,0,1|2,0,0]=4 545 B8R1.4 NC1=NC=NC(=O)N1 Z1962222528 [0,1,0,0,0,1|1,0,1]=4 546 B8R1.4 O=C1C=C(C=NN1)O Z1198169122 [0,1,0,0,0,1|2,0,0]=4 547 B8R1.4 O=C1C=CN=C(N1)S Z56771015 [0,1,0,0,0,1|2,0,0]=4 548 B8R1.4 O=C1C=CNC(=O)N1 Z56889474 [0,1,0,0,0,1|1,0,1]=4 549 B8R1.4 O=C1C=NNC(=N1)S Z2867502109 [0,1,0,0,0,1|1,0,0]=3 550 B8R1.4 O=C1C=NNC(=O)N1 Z276509088 [0,1,0,0,0,1|1,0,1]=4 551 B8R1.4 OC1=CC(=CN=C1)Br Z1172207821 [0,1,0,0,0,1|2,0,0]=4 552 B8R1.4 OC1=CC(=CN=C1)I Z1269207182 [0,1,0,0,0,1|2,0,0]=4 553 B8R1.4 OC1=CC(=NC=C1)O Z3225946514 [0,1,0,0,0,1|2,0,0]=4 554 B8R1.4 OC1=CN=CC(=C1)O Z1198158915 [0,1,0,0,0,1|2,0,0]=4 555 B8R1.4 SC1=NC(=NC=C1)S Z2311575088 [0,1,0,0,0,1|1,0,1]=4 556 B8R1.4 [O-][N+]1=CC(=NC=C1)Cl Z1255465409 [0,1,0,0,0,1|1,0,1]=4 557 B8R1.5 BrC1=C(C=CN=C1)I Z1269120686 [0,1,0,0,0,1|2,0,0]=4 558 B8R1.5 CC1=C(C=CC=C1)C Z212053190 [0,1,0,0,0,1|2,0,0]=4 559 B8R1.5 CC1=C(C=CC=C1)F Z104474026 [0,1,0,0,0,1|2,0,0]=4 560 B8R1.5 CC1=C(C=CC=C1)N Z57127943 [0,1,0,0,0,1|2,0,0]=4 561 B8R1.5 CC1=C(C=CC=C1)O Z104473822 [0,1,0,0,0,1|2,0,0]=4 562 B8R1.5 CC1=C(C=CC=N1)I Z1269190410 [0,1,0,0,0,1|1,0,0]=3 563 B8R1.5 CC1=C(C=CN=C1)Br Z1201621264 [0,1,0,0,0,1|1,0,0]=3 564 B8R1.5 CC1=C(C=CN=N1)N Z1964347676 [0,1,0,0,0,1|1,0,0]=3 565 B8R1.5 CC1=C(C=NC=C1)Br Z1255379175 [0,1,0,0,0,1|1,0,1]=4 566 B8R1.5 CC1=C(C=NC=C1)N Z625801040 [0,1,0,0,0,1|1,0,1]=4 567 B8R1.5 CC1=C(C=NN=C1)N Z1203587249 [0,1,0,0,0,1|1,0,1]=4 568 B8R1.5 CC1=C(CNCC1)C Z1966489842 [0,1,0,0,0,1|1,0,1]=4 569 B8R1.5 CC1=C(N=CC=C1)Br Z968908232 [0,1,0,0,0,1|1,0,0]=3 570 B8R1.5 CC1=C(N=CC=C1)C Z104472816 [0,1,0,0,0,1|1,0,0]=3 571 B8R1.5 CC1=C(N=CC=C1)N Z203045034 [0,1,0,0,0,1|1,0,0]=3 572 B8R1.5 CC1=C(N=CC=C1)S Z968907338 [0,1,0,0,0,1|1,0,0]=3 573 B8R1.5 CC1=C(N=CC=N1)Br Z1198181977 [0,1,0,0,0,1|0,0,1]=3 574 B8R1.5 CC1=C(N=CC=N1)C Z448248230 [0,1,0,0,0,1|0,0,1]=3 575 B8R1.5 CC1=C(N=CC=N1)Cl Z1198147877 [0,1,0,0,0,1|0,0,1]=3 576 B8R1.5 CC1=C(N=CC=N1)F Z1551948468 [0,1,0,0,0,1|0,0,1]=3 577 B8R1.5 CC1=C(N=CC=N1)N Z3068686273 [0,1,0,0,0,1|0,0,1]=3 578 B8R1.5 CC1=C(N=CC=N1)O Z1198157257 [0,1,0,0,0,1|0,0,1]=3 579 B8R1.5 CC1=C(N=CN=C1)C Z2760929781 [0,1,0,0,0,1|0,0,1]=3 580 B8R1.5 CC1=C(N=CN=C1)Cl Z1198176691 [0,1,0,0,0,1|0,0,1]=3 581 B8R1.5 CC1=C(N=NC=C1)Cl Z1198179855 [0,1,0,0,0,1|1,0,1]=4 582 B8R1.5 CC1=CC=CNC1=O Z1013766914 [0,1,0,0,0,1|1,0,0]=3 583 B8R1.5 CC1=CC=NNC1=O Z3227035121 [0,1,0,0,0,1|1,0,0]=3 584 B8R1.5 CC1=CNC=CC1=N Z1263529539 [0,1,0,0,0,1|1,0,0]=3 585 B8R1.5 CC1=[N+](C=CC=C1)C Z56791140 [0,1,0,0,0,1|1,0,1]=4 586 B8R1.5 CC1=[N+](C=CC=C1)N Z57931449 [0,1,0,0,0,1|1,0,1]=4 587 B8R1.5 CN1C=CC=NC1=O Z1198218328 [0,1,0,0,0,1|2,0,0]=4 588 B8R1.5 ClC1=C(C=CC=N1)Br Z808600354 [0,1,0,0,0,1|2,0,0]=4 589 B8R1.5 ClC1=C(C=NC=C1)Cl Z1575308475 [0,1,0,0,0,1|2,0,0]=4 590 B8R1.5 ClC1=C(C=NC=N1)Br Z1079255426 [0,1,0,0,0,1|1,0,1]=4 591 B8R1.5 ClC1=C(C=NC=N1)I Z1079458538 [0,1,0,0,0,1|1,0,1]=4 592 B8R1.5 ClC1=C(N=CC=C1)Br Z415645050 [0,1,0,0,0,1|2,0,0]=4 593 B8R1.5 ClC1=C(N=CC=C1)Cl Z164708870 [0,1,0,0,0,1|2,0,0]=4 594 B8R1.5 ClC1=C(N=CC=N1)Br Z1255362476 [0,1,0,0,0,1|1,0,1]=4 595 B8R1.5 ClC1=C(N=CC=N1)Cl Z850504018 [0,1,0,0,0,1|1,0,1]=4 596 B8R1.5 ClC1=C(N=CC=N1)I Z1813099369 [0,1,0,0,0,1|1,0,1]=4 597 B8R1.5 ClC1=C(N=CN=C1)Cl Z1198221914 [0,1,0,0,0,1|1,0,1]=4 598 B8R1.5 FC1=C(C=CC=N1)I Z1238548161 [0,1,0,0,0,1|2,0,0]=4 599 B8R1.5 FC1=C(C=CN=C1)I Z1269153298 [0,1,0,0,0,1|2,0,0]=4 600 B8R1.5 FC1=C(N=CC=C1)Br Z997724396 [0,1,0,0,0,1|2,0,0]=4 601 B8R1.5 FC1=C(N=CC=C1)Cl Z850328566 [0,1,0,0,0,1|2,0,0]=4 602 B8R1.5 FC1=C(N=CC=N1)Cl Z1551935456 [0,1,0,0,0,1|1,0,1]=4 603 B8R1.5 FC1=C(N=CN=C1)Cl Z1201625151 [0,1,0,0,0,1|1,0,1]=4 604 B8R1.5 NC1=C(C=CC=N1)I Z363805876 [0,1,0,0,0,1|2,0,0]=4 605 B8R1.5 NC1=C(C=CC=N1)O Z104495292 [0,1,0,0,0,1|2,0,0]=4 606 B8R1.5 NC1=C(C=CN=C1)Cl Z1198095644 [0,1,0,0,0,1|2,0,0]=4 607 B8R1.5 NC1=C(C=CN=C1)O Z370653926 [0,1,0,0,0,1|2,0,0]=4 608 B8R1.5 NC1=C(C=NC=C1)Cl Z56914824 [0,1,0,0,0,1|2,0,0]=4 609 B8R1.5 NC1=C(C=NC=C1)N Z385438794 [0,1,0,0,0,1|2,0,0]=4 610 B8R1.5 NC1=C(C=NC=C1)O Z1664348606 [0,1,0,0,0,1|2,0,0]=4 611 B8R1.5 NC1=C(C=NC=N1)Br Z1198152536 [0,1,0,0,0,1|1,0,1]=4 612 B8R1.5 NC1=C(C=NC=N1)F Z1255487690 [0,1,0,0,0,1|1,0,1]=4 613 B8R1.5 NC1=C(N=CC=C1)Cl Z104475710 [0,1,0,0,0,1|2,0,0]=4 614 B8R1.5 NC1=C(N=CC=C1)N Z385438806 [0,1,0,0,0,1|2,0,0]=4 615 B8R1.5 NC1=C(N=CC=C1)O Z969560564 [0,1,0,0,0,1|2,0,0]=4 616 B8R1.5 NC1=C(N=CC=C1)S Z411993618 [0,1,0,0,0,1|2,0,0]=4 617 B8R1.5 NC1=C(N=CC=N1)N Z1198174211 [0,1,0,0,0,1|1,0,1]=4 618 B8R1.5 NC1=C(N=CC=N1)S Z1203579756 [0,1,0,0,0,1|1,0,1]=4 619 B8R1.5 NC1=C(N=CN=C1)N Z316094270 [0,1,0,0,0,1|1,0,1]=4 620 B8R1.5 NC1=CC=NNC1=O Z3034935799 [0,1,0,0,0,1|2,0,0]=4 621 B8R1.5 NC1=CNC=NC1=O Z2213893347 [0,1,0,0,0,1|1,0,0]=3 622 B8R1.5 NC1=NC=CNC1=O Z3225902419 [0,1,0,0,0,1|1,0,0]=3 623 B8R1.5 O=C1NC=CC=C1I Z1269208652 [0,1,0,0,0,1|2,0,0]=4 624 B8R1.5 O=C1NC=CC=C1O Z104495360 [0,1,0,0,0,1|2,0,0]=4 625 B8R1.5 O=C1NC=NC=C1Br Z1416282441 [0,1,0,0,0,1|1,0,0]=3 626 B8R1.5 O=C1NC=NC=C1F Z2235386850 [0,1,0,0,0,1|1,0,0]=3 627 B8R1.5 OC1=C(C=CC=N1)F Z850327726 [0,1,0,0,0,1|2,0,0]=4 628 B8R1.5 OC1=C(C=NC=N1)Cl Z1198222685 [0,1,0,0,0,1|1,0,1]=4 629 B8R1.5 OC1=C(N=CC=C1)F Z1198164106 [0,1,0,0,0,1|2,0,0]=4 630 B8R1.5 SC1=C(C=CC=N1)Br Z808603100 [0,1,0,0,0,1|2,0,0]=4 631 B8R1.5 SC1=C(C=CC=N1)Cl Z220567008 [0,1,0,0,0,1|2,0,0]=4 632 B8R1.1 C#CC1=CN(N=C1)C Z1080385590 [0,2,0,0,0,0|2,0,0]=4 633 B8R1.1 C#CC1=CSC(=N1)C Z1255434142 [0,2,0,0,0,0|1,0,1]=4 634 B8R1.1 C=CC1=CN(N=C1)C Z1238836268 [0,2,0,0,0,0|2,0,0]=4 635 B8R1.1 CC1=CC(=CS1)C=O Z1198175165 [0,2,0,0,0,0|2,0,0]=4 636 B8R1.1 CC1=CC(=NO1)CCl Z90122430 [0,2,0,0,0,0|2,0,0]=4 637 B8R1.1 CC1=CC=C(N1)C=O Z1198176668 [0,2,0,0,0,0|1,0,1]=4 638 B8R1.1 CC1=CC=C(O1)C#N Z56963430 [0,2,0,0,0,0|2,0,0]=4 639 B8R1.1 CC1=CC=C(O1)C=O Z56899216 [0,2,0,0,0,0|2,0,0]=4 640 B8R1.1 CC1=CC=C(O1)CO Z335244864 [0,2,0,0,0,0|2,0,0]=4 641 B8R1.1 CC1=CC=C(S1)C#N Z336080058 [0,2,0,0,0,0|2,0,0]=4 642 B8R1.1 CC1=CC=C(S1)C=O Z104478048 [0,2,0,0,0,0|2,0,0]=4 643 B8R1.1 CC1=CC=C(S1)CO Z381678056 [0,2,0,0,0,0|2,0,0]=4 644 B8R1.1 CC1=CN=C(N1)C#N Z2678251399 [0,2,0,0,0,0|0,0,2]=4 645 B8R1.1 CC1=CN=C(O1)C=O Z1198163538 [0,2,0,0,0,0|1,0,1]=4 646 B8R1.1 CC1=CN=C(O1)CN Z1198236438 [0,2,0,0,0,0|1,0,1]=4 647 B8R1.1 CC1=CN=C(O1)CO Z1198313418 [0,2,0,0,0,0|1,0,1]=4 648 B8R1.1 CC1=CN=C(S1)C#N Z1198312937 [0,2,0,0,0,0|1,0,1]=4 649 B8R1.1 CC1=CN=C(S1)C=O Z1037606518 [0,2,0,0,0,0|1,0,1]=4 650 B8R1.1 CC1=CN=C(S1)CN Z994267440 [0,2,0,0,0,0|1,0,1]=4 651 B8R1.1 CC1=CNC(=N1)C=O Z1198166211 [0,2,0,0,0,0|0,0,0]=2 652 B8R1.1 CC1=CNC(=N1)CO Z3015789123 [0,2,0,0,0,0|0,0,0]=2 653 B8R1.1 CC1=COC(=C1)C=O Z1255374618 [0,2,0,0,0,0|2,0,0]=4 654 B8R1.1 CC1=COC(=N1)C=O Z1198279988 [0,2,0,0,0,0|1,0,0]=3 655 B8R1.1 CC1=CSC(=C1)C=O Z1255423820 [0,2,0,0,0,0|2,0,0]=4 656 B8R1.1 CC1=CSC(=C1)CN Z2235810231 [0,2,0,0,0,0|2,0,0]=4 657 B8R1.1 CC1=CSC(=N1)C#N Z1255395879 [0,2,0,0,0,0|1,0,0]=3 658 B8R1.1 CC1=CSC(=N1)C=O Z1037606426 [0,2,0,0,0,0|1,0,0]=3 659 B8R1.1 CC1=CSC(=N1)CO Z1037609598 [0,2,0,0,0,0|1,0,0]=3 660 B8R1.1 CC1=CSC(=N1)NN Z57980667 [0,2,0,0,0,0|1,0,0]=3 661 B8R1.1 CC1=NC(=CN1)C=O Z1013690328 [0,2,0,0,0,0|0,0,1]=3 662 B8R1.1 CC1=NC(=CO1)C=O Z1162445877 [0,2,0,0,0,0|1,0,1]=4 663 B8R1.1 CC1=NC(=CS1)C#N Z1255486416 [0,2,0,0,0,0|1,0,1]=4 664 B8R1.1 CC1=NC(=CS1)C=O Z90662164 [0,2,0,0,0,0|1,0,1]=4 665 B8R1.1 CC1=NC(=CS1)CCl Z56943451 [0,2,0,0,0,0|1,0,0]=3 666 B8R1.1 CC1=NC(=CS1)CN Z54749838 [0,2,0,0,0,0|1,0,0]=3 667 B8R1.1 CC1=NC(=NN1)CN Z2895197976 [0,2,0,0,0,0|1,0,0]=3 668 B8R1.1 CC1=NC(=NN1)CO Z1431002733 [0,2,0,0,0,0|1,0,0]=3 669 B8R1.1 CC1=NC(=NO1)CN Z1357774192 [0,2,0,0,0,0|1,0,1]=4 670 B8R1.1 CC1=NC(=NO1)CO Z431951982 [0,2,0,0,0,0|1,0,1]=4 671 B8R1.1 CC1=NC=C(O1)C=O Z1198169811 [0,2,0,0,0,0|2,0,0]=4 672 B8R1.1 CC1=NC=C(S1)C#N Z1198323669 [0,2,0,0,0,0|2,0,0]=4 673 B8R1.1 CC1=NC=C(S1)C=O Z425450926 [0,2,0,0,0,0|2,0,0]=4 674 B8R1.1 CC1=NC=C(S1)CO Z608610310 [0,2,0,0,0,0|1,0,1]=4 675 B8R1.1 CC1=NNC(=C1)C=O Z275128658 [0,2,0,0,0,0|2,0,0]=4 676 B8R1.1 CC1=NOC(=C1)C=O Z1079442828 [0,2,0,0,0,0|2,0,0]=4 677 B8R1.1 CC1=NOC(=C1)CCl Z119990894 [0,2,0,0,0,0|2,0,0]=4 678 B8R1.1 CC1=NOC(=C1)CO Z431951966 [0,2,0,0,0,0|2,0,0]=4 679 B8R1.1 CC1=NOC(=N1)CN Z802671508 [0,2,0,0,0,0|1,0,1]=4 680 B8R1.1 CC1=NOC(=N1)CO Z431951984 [0,2,0,0,0,0|1,0,1]=4 681 B8R1.1 CC1=NSC(=C1)C=O Z1079104480 [0,2,0,0,0,0|2,0,0]=4 682 B8R1.1 CCC1=CC(=CS1)Br Z1255374735 [0,2,0,0,0,0|2,0,0]=4 683 B8R1.1 CCC1=CN=C(O1)N Z994289172 [0,2,0,0,0,0|1,0,1]=4 684 B8R1.1 CCC1=CN=C(S1)N Z851799002 [0,2,0,0,0,0|1,0,1]=4 685 B8R1.1 CCC1=CNC(=O)N1 Z1198151065 [0,2,0,0,0,0|0,0,1]=3 686 B8R1.1 CCC1=CSC(=N1)Cl Z1037582854 [0,2,0,0,0,0|1,0,0]=3 687 B8R1.1 CCC1=CSC(=N1)N Z1263824431 [0,2,0,0,0,0|1,0,0]=3 688 B8R1.1 CCC1=CSC(=O)N1 Z916925862 [0,2,0,0,0,0|1,0,1]=4 689 B8R1.1 CCC1=NC(=NS1)N Z1203581808 [0,2,0,0,0,0|1,0,1]=4 690 B8R1.1 CCC1=NNC(=C1)N Z360168062 [0,2,0,0,0,0|2,0,0]=4 691 B8R1.1 CCC1=NNC(=N1)C Z1271843082 [0,2,0,0,0,0|1,0,0]=3 692 B8R1.1 CCC1=NNC(=N1)N Z1431904363 [0,2,0,0,0,0|1,0,0]=3 693 B8R1.1 CCC1=NNC(=N1)S Z55982179 [0,2,0,0,0,0|1,0,0]=3 694 B8R1.1 CCC1=NOC(=C1)N Z360168622 [0,2,0,0,0,0|2,0,0]=4 695 B8R1.1 CCC1=NOC(=N1)N Z991477732 [0,2,0,0,0,0|2,0,0]=4 696 B8R1.1 CCN1C=C(C=N1)O Z1165304366 [0,2,0,0,0,0|2,0,0]=4 697 B8R1.1 CCN1C=C(N=N1)N Z1198175659 [0,2,0,0,0,0|2,0,0]=4 698 B8R1.1 CCN1C=CC(=N1)C Z2696515582 [0,2,0,0,0,0|2,0,0]=4 699 B8R1.1 CCN1C=CC(=N1)O Z2941655720 [0,2,0,0,0,0|2,0,0]=4 700 B8R1.1 CCN1C=C[N+](=C1)C Z2050687912 [0,2,0,0,0,0|2,0,0]=4 701 B8R1.1 CCN1C=NC(=C1)N Z2313530831 [0,2,0,0,0,0|1,0,0]=3 702 B8R1.1 CCN1C=NC(=N1)N Z600615070 [0,2,0,0,0,0|1,0,1]=4 703 B8R1.1 CN1C=C(C=N1)C#N Z381355294 [0,2,0,0,0,0|2,0,0]=4 704 B8R1.1 CN1C=C(C=N1)C=O Z99601138 [0,2,0,0,0,0|2,0,0]=4 705 B8R1.1 CN1C=C(C=N1)CN Z317041916 [0,2,0,0,0,0|2,0,0]=4 706 B8R1.1 CN1C=C(C=N1)CO Z198954582 [0,2,0,0,0,0|2,0,0]=4 707 B8R1.1 CN1C=C(N=N1)C#N Z1695554419 [0,2,0,0,0,0|1,0,1]=4 708 B8R1.1 CN1C=C(N=N1)C=O Z1013717706 [0,2,0,0,0,0|1,0,1]=4 709 B8R1.1 CN1C=C(N=N1)CN Z2596802308 [0,2,0,0,0,0|1,0,0]=3 710 B8R1.1 CN1C=C(N=N1)CO Z982118318 [0,2,0,0,0,0|1,0,0]=3 711 B8R1.1 CN1C=CC(=C1)C#N Z1198315030 [0,2,0,0,0,0|1,0,1]=4 712 B8R1.1 CN1C=CC(=C1)C=O Z1198160553 [0,2,0,0,0,0|1,0,1]=4 713 B8R1.1 CN1C=CC(=N1)C#N Z1116334547 [0,2,0,0,0,0|2,0,0]=4 714 B8R1.1 CN1C=CC(=N1)C=O Z1065726004 [0,2,0,0,0,0|2,0,0]=4 715 B8R1.1 CN1C=CC(=N1)CN Z2724335171 [0,2,0,0,0,0|2,0,0]=4 716 B8R1.1 CN1C=CC(=N1)CO Z802669186 [0,2,0,0,0,0|2,0,0]=4 717 B8R1.1 CN1C=NC(=C1)C#N Z1116366025 [0,2,0,0,0,0|0,0,1]=3 718 B8R1.1 CN1C=NC(=C1)C=O Z1201622215 [0,2,0,0,0,0|0,0,1]=3 719 B8R1.1 CN1C=NC(=C1)CO Z1137167436 [0,2,0,0,0,0|0,0,0]=2 720 B8R1.1 CN1N=CC(=N1)CN Z1203652613 [0,2,0,0,0,0|1,0,1]=4 721 B8R1.1 CN1N=CC(=N1)CO Z1896980083 [0,2,0,0,0,0|1,0,1]=4 722 B8R1.1 CN1N=NC(=N1)CN Z1895583562 [0,2,0,0,0,0|2,0,0]=4 723 B8R1.1 CNC1=CN(N=C1)C Z1255523371 [0,2,0,0,0,0|2,0,0]=4 724 B8R1.1 CNC1=NC(=CS1)C Z48860943 [0,2,0,0,0,0|1,0,0]=3 725 B8R1.1 CNC1=NC(=NN1)N Z1483956641 [0,2,0,0,0,0|1,0,1]=4 726 B8R1.1 CNC1=NC(=NS1)C Z1203731956 [0,2,0,0,0,0|1,0,1]=4 727 B8R1.1 CNC1=NC(=O)CS1 Z1203731442 [0,2,0,0,0,0|2,0,0]=4 728 B8R1.1 CNC1=NC=C(S1)C Z3333486563 [0,2,0,0,0,0|1,0,1]=4 729 B8R1.1 CNC1=NN(C=C1)C Z1723633645 [0,2,0,0,0,0|2,0,0]=4 730 B8R1.1 CNC1=NOC(=C1)C Z3069017324 [0,2,0,0,0,0|2,0,0]=4 731 B8R1.1 COC1=CC(=NN1)C Z1813157463 [0,2,0,0,0,0|2,0,0]=4 732 B8R1.1 COC1=CC(=O)NC1 Z1203730872 [0,2,0,0,0,0|1,0,1]=4 733 B8R1.1 COC1=NC(=NN1)N Z1203581724 [0,2,0,0,0,0|1,0,1]=4 734 B8R1.1 COC1=NNC(=C1)N Z2658869770 [0,2,0,0,0,0|2,0,0]=4 735 B8R1.1 COC1=NSC(=C1)N Z3004727765 [0,2,0,0,0,0|2,0,0]=4 736 B8R1.1 CSC1=NC(=NN1)C Z3223608753 [0,2,0,0,0,0|1,0,0]=3 737 B8R1.1 CSC1=NC(=O)CN1 Z2602503120 [0,2,0,0,0,0|1,0,1]=4 738 B8R1.1 CSC1=NC(=O)NN1 Z1799834383 [0,2,0,0,0,0|1,0,0]=3 739 B8R1.1 CSC1=NSC(=N1)N Z96092037 [0,2,0,0,0,0|2,0,0]=4 740 B8R1.1 ClCC1=CC=C(S1)Cl Z57039589 [0,2,0,0,0,0|2,0,0]=4 741 B8R1.1 N#CC1=CC(=CN1)Br Z1262615834 [0,2,0,0,0,0|2,0,0]=4 742 B8R1.1 N#CC1=CC(=CN1)I Z1509168242 [0,2,0,0,0,0|2,0,0]=4 743 B8R1.1 NC1=NC(=CS1)CCl Z234904524 [0,2,0,0,0,0|1,0,0]=3 744 B8R1.1 NC1=NC(=CS1)CO Z2092371345 [0,2,0,0,0,0|1,0,0]=3 745 B8R1.1 NCC1=CC(=CN1)Br Z1278621610 [0,2,0,0,0,0|1,0,1]=4 746 B8R1.1 NCC1=CC(=CS1)Br Z234895215 [0,2,0,0,0,0|2,0,0]=4 747 B8R1.1 NCC1=CC=C(S1)Br Z336481666 [0,2,0,0,0,0|2,0,0]=4 748 B8R1.1 NCC1=CC=C(S1)Cl Z426041582 [0,2,0,0,0,0|2,0,0]=4 749 B8R1.1 NCC1=CN=C(S1)Cl Z1741976615 [0,2,0,0,0,0|1,0,1]=4 750 B8R1.1 NCC1=CN=C(S1)N Z2989210641 [0,2,0,0,0,0|1,0,1]=4 751 B8R1.1 NCC1=CSC(=C1)Br Z234896703 [0,2,0,0,0,0|2,0,0]=4 752 B8R1.1 NCC1=CSC(=N1)N Z1263820281 [0,2,0,0,0,0|1,0,0]=3 753 B8R1.1 NCC1=CSC(=O)N1 Z1434233458 [0,2,0,0,0,0|1,0,1]=4 754 B8R1.1 NCC1=NC(=NN1)N Z1318356936 [0,2,0,0,0,0|1,0,1]=4 755 B8R1.1 NCC1=NC(=O)NN1 Z1324055645 [0,2,0,0,0,0|1,0,0]=3 756 B8R1.1 NCC1=NC(=O)ON1 Z1497158708 [0,2,0,0,0,0|2,0,0]=4 757 B8R1.1 NCC1=NSC(=N1)N Z4202899873 [0,2,0,0,0,0|2,0,0]=4 758 B8R1.1 O=CC1=CC(=CN1)I Z1183442838 [0,2,0,0,0,0|2,0,0]=4 759 B8R1.1 O=CC1=CNC(=C1)Br Z1255492158 [0,2,0,0,0,0|1,0,1]=4 760 B8R1.1 O=CC1=CSC(=N1)Cl Z1201625112 [0,2,0,0,0,0|1,0,1]=4 761 B8R1.1 O=CC1=NC(=CS1)Cl Z1216838518 [0,2,0,0,0,0|2,0,0]=4 762 B8R1.1 OCC1=CC(=CS1)Br Z362636152 [0,2,0,0,0,0|2,0,0]=4 763 B8R1.1 OCC1=CC=C(S1)Cl Z381678198 [0,2,0,0,0,0|2,0,0]=4 764 B8R1.1 OCC1=CSC(=C1)Br Z431952558 [0,2,0,0,0,0|2,0,0]=4 765 B8R1.1 OCC1=CSC(=N1)S Z2863487239 [0,2,0,0,0,0|1,0,0]=3 766 B8R1.1 OCC1=NC=C(S1)Br Z1270530467 [0,2,0,0,0,0|2,0,0]=4 767 B8R1.1 OCC1=NNC(=C1)O Z1198176676 [0,2,0,0,0,0|2,0,0]=4 768 B8R1.1 OCN1C=C(C=N1)Br Z1198179991 [0,2,0,0,0,0|2,0,0]=4 769 B8R1.7 CC(=O)C1=CC=CN1 Z56899162 [0,2,0,0,0,0|1,0,1]=4 770 B8R1.7 CC(=O)C1=CC=CS1 Z57127896 [0,2,0,0,0,0|2,0,0]=4 771 B8R1.7 CC(=O)C1=CN=CO1 Z1255430875 [0,2,0,0,0,0|1,0,1]=4 772 B8R1.7 CC(=O)C1=CNC=C1 Z1154253452 [0,2,0,0,0,0|1,0,0]=3 773 B8R1.7 CC(=O)C1=CNC=N1 Z1198183596 [0,2,0,0,0,0|0,0,0]=2 774 B8R1.7 CC(=O)C1=CNN=C1 Z1966569327 [0,2,0,0,0,0|2,0,0]=4 775 B8R1.7 CC(=O)C1=CNN=N1 Z4098008860 [0,2,0,0,0,0|1,0,0]=3 776 B8R1.7 CC(=O)C1=COC=C1 Z1137167495 [0,2,0,0,0,0|2,0,0]=4 777 B8R1.7 CC(=O)C1=COC=N1 Z1255437997 [0,2,0,0,0,0|1,0,0]=3 778 B8R1.7 CC(=O)C1=CSC=C1 Z513734012 [0,2,0,0,0,0|2,0,0]=4 779 B8R1.7 CC(=O)C1=CSC=N1 Z1198162939 [0,2,0,0,0,0|1,0,0]=3 780 B8R1.7 CC(=O)C1=CSN=N1 Z1386913199 [0,2,0,0,0,0|2,0,0]=4 781 B8R1.7 CC(=O)C1=NC=CN1 Z2768175711 [0,2,0,0,0,0|2,0,0]=4 782 B8R1.7 CC(=O)C1=NC=CO1 Z1198173545 [0,2,0,0,0,0|2,0,0]=4 783 B8R1.7 CC(=O)C1=NC=CS1 Z1069877574 [0,2,0,0,0,0|2,0,0]=4 784 B8R1.7 CC(=O)C1=NNC=C1 Z1201023059 [0,2,0,0,0,0|2,0,0]=4 785 B8R1.7 CC(=O)C1=NNC=N1 Z1216858052 [0,2,0,0,0,0|1,0,0]=3 786 B8R1.7 CC(=O)C1=NSC=C1 Z1513630804 [0,2,0,0,0,0|2,0,0]=4 787 B8R1.7 CC(C)C1=CC=CS1 Z1198727220 [0,2,0,0,0,0|2,0,0]=4 788 B8R1.7 CC(C)C1=CNN=C1 Z2418194166 [0,2,0,0,0,0|2,0,0]=4 789 B8R1.7 CC(C)C1=NC=CN1 Z335243296 [0,2,0,0,0,0|2,0,0]=4 790 B8R1.7 CC(C)C1=NNC=C1 Z815437700 [0,2,0,0,0,0|2,0,0]=4 791 B8R1.7 CC(C)N1C=CC=N1 Z802540402 [0,2,0,0,0,0|2,0,0]=4 792 B8R1.7 CC(N)C1=CC=CN1 Z1198171808 [0,2,0,0,0,0|1,0,1]=4 793 B8R1.7 CC(N)C1=CC=CO1 Z89283368 [0,2,0,0,0,0|2,0,0]=4 794 B8R1.7 CC(N)C1=CC=CS1 Z119974474 [0,2,0,0,0,0|2,0,0]=4 795 B8R1.7 CC(N)C1=CNC=N1 Z1198180341 [0,2,0,0,0,0|0,0,0]=2 796 B8R1.7 CC(N)C1=CNN=C1 Z4606013370 [0,2,0,0,0,0|2,0,0]=4 797 B8R1.7 CC(N)C1=COC=C1 Z1436472920 [0,2,0,0,0,0|2,0,0]=4 798 B8R1.7 CC(N)C1=COC=N1 Z3629373018 [0,2,0,0,0,0|1,0,0]=3 799 B8R1.7 CC(N)C1=CSC=C1 Z513796194 [0,2,0,0,0,0|2,0,0]=4 800 B8R1.7 CC(N)C1=NC=CO1 Z1962224571 [0,2,0,0,0,0|2,0,0]=4 801 B8R1.7 CC(N)C1=NC=CS1 Z803082278 [0,2,0,0,0,0|2,0,0]=4 802 B8R1.7 CC(N)C1=NNC=N1 Z1274177567 [0,2,0,0,0,0|1,0,0]=3 803 B8R1.7 CC(O)C1=CC=CS1 Z335245078 [0,2,0,0,0,0|2,0,0]=4 804 B8R1.7 CC(O)C1=CNC=N1 Z1198180340 [0,2,0,0,0,0|0,0,0]=2 805 B8R1.7 CC(O)C1=CSN=N1 Z1766930027 [0,2,0,0,0,0|2,0,0]=4 806 B8R1.7 CC(O)C1=NC=CN1 Z4326395573 [0,2,0,0,0,0|2,0,0]=4 807 B8R1.7 CC(O)C1=NC=CS1 Z1069884516 [0,2,0,0,0,0|2,0,0]=4 808 B8R1.7 CC(O)C1=NNC=C1 Z655071084 [0,2,0,0,0,0|2,0,0]=4 809 B8R1.7 C[C@@H](N)C1=NC=CN1 Z2472857467 [0,2,0,0,0,0|2,0,0]=4 810 B8R1.7 C[C@@H](O)C1=CN=CS1 Z1217177234 [0,2,0,0,0,0|1,0,1]=4 811 B8R1.7 C[C@H](N)C1=CC=CO1 Z1407007556 [0,2,0,0,0,0|2,0,0]=4 812 B8R1.7 C[C@H](N)C1=NC=CN1 Z2205958486 [0,2,0,0,0,0|2,0,0]=4 813 B8R1.7 FC(F)N1C=CC=N1 Z339274954 [0,2,0,0,0,0|2,0,0]=4 814 B8R1.7 N=C(N)C1=CNN=N1 Z2168499549 [0,2,0,0,0,0|1,0,1]=4 815 B8R1.7 N=C(N)C1=COC=N1 Z4764577160 [0,2,0,0,0,0|1,0,1]=4 816 B8R1.7 N=C(N)C1=CSC=N1 Z1723936828 [0,2,0,0,0,0|1,0,1]=4 817 B8R1.7 NC(=O)C1=CNC=C1 Z1167406084 [0,2,0,0,0,0|1,0,1]=4 818 B8R1.7 NC(=O)C1=CNC=N1 Z1147451838 [0,2,0,0,0,0|0,0,1]=3 819 B8R1.7 NC(=O)C1=CNN=N1 Z803943044 [0,2,0,0,0,0|1,0,1]=4 820 B8R1.7 NC(=O)C1=COC=N1 Z1127744342 [0,2,0,0,0,0|1,0,1]=4 821 B8R1.7 O=C(O)C1=CNC=C1 Z1154253207 [0,2,0,0,0,0|1,0,1]=4 822 B8R1.7 O=C(O)C1=CNN=N1 Z1814381620 [0,2,0,0,0,0|1,0,1]=4 823 B8R1.7 O=C(O)C1=COC=N1 Z1095349994 [0,2,0,0,0,0|1,0,1]=4 824 B8R1.7 O=C(O)C1=CSC=N1 Z800222638 [0,2,0,0,0,0|1,0,1]=4 825 B8R1.7 O=[N+]([O-])C1=CNC=N1 Z235345333 [0,2,0,0,0,0|1,0,0]=3 826 B8R1.7 O=[N+]([O-])C1=CNN=N1 Z2687203948 [0,2,0,0,0,0|2,0,0]=4 827 B8R1.8 C#CCN1C=CC=N1 Z804946014 [0,2,0,0,0,0|2,0,0]=4 828 B8R1.8 CCCC1=CNN=C1 Z1263714332 [0,2,0,0,0,0|2,0,0]=4 829 B8R1.8 CCCC1=NC=CN1 Z1201043633 [0,2,0,0,0,0|2,0,0]=4 830 B8R1.8 CCCC1=NNC=N1 Z803077816 [0,2,0,0,0,0|1,0,0]=3 831 B8R1.8 CCNC1=NC=CN1 Z1463350447 [0,2,0,0,0,0|2,0,0]=4 832 B8R1.8 CCNC1=NC=CS1 Z86243266 [0,2,0,0,0,0|2,0,0]=4 833 B8R1.8 CCNC1=NC=NN1 Z1203735308 [0,2,0,0,0,0|1,0,1]=4 834 B8R1.8 CCOC1=CNN=C1 Z1726113833 [0,2,0,0,0,0|2,0,0]=4 835 B8R1.8 CCOC1=NNC=C1 Z1416187675 [0,2,0,0,0,0|2,0,0]=4 836 B8R1.8 CNCC1=CC=CN1 Z102767010 [0,2,0,0,0,0|1,0,1]=4 837 B8R1.8 CNCC1=CC=CO1 Z57051072 [0,2,0,0,0,0|2,0,0]=4 838 B8R1.8 CNCC1=CC=CS1 Z56948283 [0,2,0,0,0,0|2,0,0]=4 839 B8R1.8 CNCC1=CNN=C1 Z1267881670 [0,2,0,0,0,0|2,0,0]=4 840 B8R1.8 CNCC1=CNN=N1 Z2568737812 [0,2,0,0,0,0|1,0,0]=3 841 B8R1.8 CNCC1=COC=C1 Z385447092 [0,2,0,0,0,0|2,0,0]=4 842 B8R1.8 CNCC1=CSC=C1 Z57206125 [0,2,0,0,0,0|2,0,0]=4 843 B8R1.8 CNCC1=CSC=N1 Z138108610 [0,2,0,0,0,0|1,0,0]=3 844 B8R1.8 CNCC1=NC=CN1 Z445210554 [0,2,0,0,0,0|2,0,0]=4 845 B8R1.8 CNCC1=NC=CO1 Z5810628036 [0,2,0,0,0,0|2,0,0]=4 846 B8R1.8 CNCC1=NC=CS1 Z802607826 [0,2,0,0,0,0|2,0,0]=4 847 B8R1.8 CNCC1=NNC=C1 Z445185804 [0,2,0,0,0,0|2,0,0]=4 848 B8R1.8 CNCC1=NNN=N1 Z1250080922 [0,2,0,0,0,0|2,0,0]=4 849 B8R1.8 CNCC1=NOC=C1 Z802903302 [0,2,0,0,0,0|2,0,0]=4 850 B8R1.8 CNCC1=NOC=N1 Z2143572220 [0,2,0,0,0,0|2,0,0]=4 851 B8R1.8 COCC1=CNC=N1 Z1203733599 [0,2,0,0,0,0|0,0,0]=2 852 B8R1.8 COCC1=NC=CN1 Z1203733422 [0,2,0,0,0,0|2,0,0]=4 853 B8R1.8 COCC1=NNC=C1 Z1270114780 [0,2,0,0,0,0|2,0,0]=4 854 B8R1.8 COCC1=NNC=N1 Z1201627056 [0,2,0,0,0,0|1,0,0]=3 855 B8R1.8 N#CCC1=CC=CN1 Z810507734 [0,2,0,0,0,0|1,0,1]=4 856 B8R1.8 N#CCC1=CN=CN1 Z1198166128 [0,2,0,0,0,0|0,0,2]=4 857 B8R1.8 N#CCC1=CNN=C1 Z875024638 [0,2,0,0,0,0|2,0,0]=4 858 B8R1.8 N#CCC1=CSC=C1 Z111869576 [0,2,0,0,0,0|2,0,0]=4 859 B8R1.8 N#CCC1=CSC=N1 Z164707272 [0,2,0,0,0,0|1,0,0]=3 860 B8R1.8 N#CCC1=NC=CN1 Z331689878 [0,2,0,0,0,0|2,0,0]=4 861 B8R1.8 N#CCC1=NOC=C1 Z1192378401 [0,2,0,0,0,0|2,0,0]=4 862 B8R1.8 N#CCN1C=CC=N1 Z295205174 [0,2,0,0,0,0|2,0,0]=4 863 B8R1.8 N#CCN1C=NC=N1 Z295205188 [0,2,0,0,0,0|1,0,1]=4 864 B8R1.8 NCCC1=CC=CN1 Z810507730 [0,2,0,0,0,0|1,0,1]=4 865 B8R1.8 NCCC1=CC=CO1 Z1694636467 [0,2,0,0,0,0|2,0,0]=4 866 B8R1.8 NCCC1=CC=CS1 Z90662945 [0,2,0,0,0,0|2,0,0]=4 867 B8R1.8 NCCC1=CNC=N1 Z1267773750 [0,2,0,0,0,0|0,0,0]=2 868 B8R1.8 NCCC1=CNN=C1 Z336080532 [0,2,0,0,0,0|2,0,0]=4 869 B8R1.8 NCCC1=CNN=N1 Z3005762594 [0,2,0,0,0,0|1,0,0]=3 870 B8R1.8 NCCC1=COC=C1 Z2310701825 [0,2,0,0,0,0|2,0,0]=4 871 B8R1.8 NCCC1=NC=CO1 Z4925106850 [0,2,0,0,0,0|2,0,0]=4 872 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,2,0,0,0,0|2,0,0]=4 873 B8R1.8 NCCC1=NNC=C1 Z2867120994 [0,2,0,0,0,0|2,0,0]=4 874 B8R1.8 NCCC1=NOC=N1 Z1262691677 [0,2,0,0,0,0|2,0,0]=4 875 B8R1.8 NCCN1C=CC=N1 Z271005714 [0,2,0,0,0,0|2,0,0]=4 876 B8R1.8 NCCN1C=NC=N1 Z381061410 [0,2,0,0,0,0|1,0,1]=4 877 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [0,2,0,0,0,0|2,0,0]=4 878 B8R1.8 O=CCC1=CC=CS1 Z993017816 [0,2,0,0,0,0|2,0,0]=4 879 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [0,2,0,0,0,0|2,0,0]=4 880 B8R1.8 OCCC1=CC=CO1 Z1179944660 [0,2,0,0,0,0|2,0,0]=4 881 B8R1.8 OCCC1=CC=CS1 Z397587354 [0,2,0,0,0,0|2,0,0]=4 882 B8R1.8 OCCC1=CN=CS1 Z1198334159 [0,2,0,0,0,0|1,0,1]=4 883 B8R1.8 OCCC1=CNN=C1 Z1333876037 [0,2,0,0,0,0|2,0,0]=4 884 B8R1.8 OCCC1=CNN=N1 Z982120080 [0,2,0,0,0,0|1,0,0]=3 885 B8R1.8 OCCC1=COC=C1 Z1179944659 [0,2,0,0,0,0|2,0,0]=4 886 B8R1.8 OCCC1=CSC=C1 Z397587098 [0,2,0,0,0,0|2,0,0]=4 887 B8R1.8 OCCC1=CSC=N1 Z1263714384 [0,2,0,0,0,0|1,0,0]=3 888 B8R1.8 OCCN1C=CC=N1 Z425794824 [0,2,0,0,0,0|2,0,0]=4 889 B8R1.8 OCCN1C=NC=N1 Z234898253 [0,2,0,0,0,0|1,0,1]=4 890 B8R1.11 C#CC1=CC=NN1C Z1183446001 [0,2,0,0,0,0|2,0,0]=4 891 B8R1.11 CC1=C(C=CO1)C#N Z1079178988 [0,2,0,0,0,0|2,0,0]=4 892 B8R1.11 CC1=C(C=CO1)C=O Z1079442526 [0,2,0,0,0,0|2,0,0]=4 893 B8R1.11 CC1=C(C=CO1)CN Z803145352 [0,2,0,0,0,0|2,0,0]=4 894 B8R1.11 CC1=C(C=CO1)CO Z397587324 [0,2,0,0,0,0|2,0,0]=4 895 B8R1.11 CC1=C(C=CS1)C=O Z1255365611 [0,2,0,0,0,0|2,0,0]=4 896 B8R1.11 CC1=C(C=CS1)CN Z3034293414 [0,2,0,0,0,0|2,0,0]=4 897 B8R1.11 CC1=C(C=NN1)CN Z1837077131 [0,2,0,0,0,0|2,0,0]=4 898 B8R1.11 CC1=C(C=NN1)CO Z1198107480 [0,2,0,0,0,0|2,0,0]=4 899 B8R1.11 CC1=C(N=CN1)C#N Z1203746667 [0,2,0,0,0,0|0,0,1]=3 900 B8R1.11 CC1=C(N=CN1)CN Z1318147471 [0,2,0,0,0,0|0,0,0]=2 901 B8R1.11 CC1=C(N=CN1)CO Z173808378 [0,2,0,0,0,0|0,0,0]=2 902 B8R1.11 CC1=C(N=CO1)C=O Z1198279989 [0,2,0,0,0,0|1,0,1]=4 903 B8R1.11 CC1=C(N=CS1)C=O Z1198279987 [0,2,0,0,0,0|1,0,1]=4 904 B8R1.11 CC1=C(N=CS1)CN Z317098554 [0,2,0,0,0,0|1,0,0]=3 905 B8R1.11 CC1=C(N=CS1)CO Z1198176703 [0,2,0,0,0,0|1,0,0]=3 906 B8R1.11 CC1=C(NC=N1)C=O Z2686040987 [0,2,0,0,0,0|0,0,0]=2 907 B8R1.11 CC1=C(NN=C1)C#N Z2065811193 [0,2,0,0,0,0|2,0,0]=4 908 B8R1.11 CC1=C(NN=C1)CN Z2865543087 [0,2,0,0,0,0|2,0,0]=4 909 B8R1.11 CC1=C(OC=C1)C=O Z1079442566 [0,2,0,0,0,0|2,0,0]=4 910 B8R1.11 CC1=C(OC=C1)CN Z291234200 [0,2,0,0,0,0|2,0,0]=4 911 B8R1.11 CC1=C(OC=N1)C#N Z1255488418 [0,2,0,0,0,0|1,0,0]=3 912 B8R1.11 CC1=C(OC=N1)C=O Z1198279990 [0,2,0,0,0,0|1,0,0]=3 913 B8R1.11 CC1=C(OC=N1)CN Z2939254026 [0,2,0,0,0,0|1,0,0]=3 914 B8R1.11 CC1=C(OC=N1)CO Z1198166472 [0,2,0,0,0,0|1,0,0]=3 915 B8R1.11 CC1=C(SC=C1)C#N Z381355194 [0,2,0,0,0,0|2,0,0]=4 916 B8R1.11 CC1=C(SC=C1)C=O Z104477012 [0,2,0,0,0,0|2,0,0]=4 917 B8R1.11 CC1=C(SC=C1)CN Z235352157 [0,2,0,0,0,0|2,0,0]=4 918 B8R1.11 CC1=C(SC=N1)C=O Z1079442366 [0,2,0,0,0,0|1,0,0]=3 919 B8R1.11 CC1=C(SC=N1)CN Z291234254 [0,2,0,0,0,0|1,0,0]=3 920 B8R1.11 CC1=C(SC=N1)CO Z397587526 [0,2,0,0,0,0|1,0,0]=3 921 B8R1.11 CC1=CNC=C1C#N Z1203732959 [0,2,0,0,0,0|1,0,0]=3 922 B8R1.11 CC1=CNC=C1C=O Z1203832675 [0,2,0,0,0,0|1,0,0]=3 923 B8R1.11 CC1=CNN=C1C=O Z2418414008 [0,2,0,0,0,0|2,0,0]=4 924 B8R1.11 CC1=CNN=C1CO Z1898597737 [0,2,0,0,0,0|2,0,0]=4 925 B8R1.11 CC1=COC=C1CN Z5616265876 [0,2,0,0,0,0|2,0,0]=4 926 B8R1.11 CC1=CSC=C1C#N Z1255398661 [0,2,0,0,0,0|2,0,0]=4 927 B8R1.11 CC1=CSC=C1C=O Z1201623037 [0,2,0,0,0,0|2,0,0]=4 928 B8R1.11 CC1=CSC=C1CN Z1345189827 [0,2,0,0,0,0|2,0,0]=4 929 B8R1.11 CC1=NC=CN1C#N Z1198314041 [0,2,0,0,0,0|2,0,0]=4 930 B8R1.11 CC1=NNC=C1C=O Z319610836 [0,2,0,0,0,0|2,0,0]=4 931 B8R1.11 CC1=NOC=C1C=O Z1198279977 [0,2,0,0,0,0|2,0,0]=4 932 B8R1.11 CC1=NON=C1CN Z1269638429 [0,2,0,0,0,0|1,0,1]=4 933 B8R1.11 CC1=NON=C1CO Z1188433422 [0,2,0,0,0,0|1,0,1]=4 934 B8R1.11 CC1=NSC=C1C=O Z1198279895 [0,2,0,0,0,0|2,0,0]=4 935 B8R1.11 CCC1=CNN=C1N Z1741979116 [0,2,0,0,0,0|2,0,0]=4 936 B8R1.11 CCC1=CSC=C1N Z4935394961 [0,2,0,0,0,0|2,0,0]=4 937 B8R1.11 CCC1=NON=C1N Z359374178 [0,2,0,0,0,0|1,0,1]=4 938 B8R1.11 CCC1=NSC=C1N Z5711193458 [0,2,0,0,0,0|2,0,0]=4 939 B8R1.11 CCN1C=CNC1=O Z1198329853 [0,2,0,0,0,0|2,0,0]=4 940 B8R1.11 CCN1N=CC=C1N Z56347291 [0,2,0,0,0,0|2,0,0]=4 941 B8R1.11 CCN1N=CCC1=O Z3477438900 [0,2,0,0,0,0|2,0,0]=4 942 B8R1.11 CN1C=CC=C1CN Z362827744 [0,2,0,0,0,0|1,0,1]=4 943 B8R1.11 CN1C=CN=C1CCl Z90122361 [0,2,0,0,0,0|2,0,0]=4 944 B8R1.11 CN1C=CN=C1CN Z235536854 [0,2,0,0,0,0|2,0,0]=4 945 B8R1.11 CN1C=CN=C1CO Z212169576 [0,2,0,0,0,0|2,0,0]=4 946 B8R1.11 CN1C=NC=C1CN Z1198266141 [0,2,0,0,0,0|0,0,2]=4 947 B8R1.11 CN1C=NC=C1CO Z1115775402 [0,2,0,0,0,0|0,0,2]=4 948 B8R1.11 CN1N=CC=C1C=O Z325191230 [0,2,0,0,0,0|2,0,0]=4 949 B8R1.11 CN1N=CC=C1CN Z316122740 [0,2,0,0,0,0|2,0,0]=4 950 B8R1.11 CN1N=CC=C1CO Z501748978 [0,2,0,0,0,0|2,0,0]=4 951 B8R1.11 CN1N=CN=C1CO Z2786104722 [0,2,0,0,0,0|1,0,1]=4 952 B8R1.11 CNC1=CC=NN1C Z1259162018 [0,2,0,0,0,0|2,0,0]=4 953 B8R1.11 COC1=NNC=C1C Z2943419549 [0,2,0,0,0,0|2,0,0]=4 954 B8R1.11 COC1=NSC=C1N Z2768512024 [0,2,0,0,0,0|2,0,0]=4 955 B8R1.11 CSC1=CNN=C1N Z802600050 [0,2,0,0,0,0|2,0,0]=4 956 B8R1.11 CSC1=NC=CN1C Z18499760 [0,2,0,0,0,0|2,0,0]=4 957 B8R1.11 ClCC1=C(SN=N1)Cl Z104378184 [0,2,0,0,0,0|2,0,0]=4 958 B8R1.11 NCC1=C(C=CS1)Cl Z3244521023 [0,2,0,0,0,0|2,0,0]=4 959 B8R1.11 NCC1=C(SC=C1)Cl Z4459561724 [0,2,0,0,0,0|2,0,0]=4 960 B8R1.11 NCC1=C(SC=C1)I Z4912253513 [0,2,0,0,0,0|2,0,0]=4 961 B8R1.11 O=CC1=C(C=CN1)Br Z1255436029 [0,2,0,0,0,0|2,0,0]=4 962 B8R1.11 O=CC1=C(N=CS1)Cl Z1198233922 [0,2,0,0,0,0|2,0,0]=4 963 B8R1.11 O=CC1=CNC=C1Br Z1262592887 [0,2,0,0,0,0|1,0,1]=4 964 B8R1.18 BrC1=NC(=C(N1)Br)Br Z1269217056 [0,2,0,0,0,0|1,0,0]=3 965 B8R1.18 CC1=C(NC(=N1)N)C Z2418413556 [0,2,0,0,0,0|0,0,0]=2 966 B8R1.18 CC1=C(NC(=N1)S)C Z1198163261 [0,2,0,0,0,0|0,0,0]=2 967 B8R1.18 CC1=C(NC(=O)N1)C Z147309784 [0,2,0,0,0,0|0,0,1]=3 968 B8R1.18 CC1=C(OC(=N1)N)C Z85932429 [0,2,0,0,0,0|1,0,0]=3 969 B8R1.18 CC1=C(OC(=N1)S)C Z234904536 [0,2,0,0,0,0|1,0,0]=3 970 B8R1.18 CC1=C(SC(=N1)Cl)C Z1037582644 [0,2,0,0,0,0|1,0,0]=3 971 B8R1.18 CC1=C(SC(=N1)N)Br Z3235015630 [0,2,0,0,0,0|1,0,0]=3 972 B8R1.18 CC1=C(SC(=N1)N)C Z48847528 [0,2,0,0,0,0|1,0,0]=3 973 B8R1.18 CC1=C(SC(=N1)S)C Z1198148053 [0,2,0,0,0,0|1,0,0]=3 974 B8R1.18 CC1=C(SC(=O)N1)C Z409413538 [0,2,0,0,0,0|1,0,0]=3 975 B8R1.18 CC1=CC(=C(S1)Br)C Z1255397918 [0,2,0,0,0,0|2,0,0]=4 976 B8R1.18 CC1=CC(=C(S1)C)Br Z1198655269 [0,2,0,0,0,0|2,0,0]=4 977 B8R1.18 CC1=CC(=C(S1)C)I Z1347205942 [0,2,0,0,0,0|2,0,0]=4 978 B8R1.18 CC1=CC(=C(S1)C)N Z3013884071 [0,2,0,0,0,0|2,0,0]=4 979 B8R1.18 CC1=CC(=NN1C)C Z1201023055 [0,2,0,0,0,0|2,0,0]=4 980 B8R1.18 CC1=CC(=NN1C)N Z995041200 [0,2,0,0,0,0|2,0,0]=4 981 B8R1.18 CC1=CC(=O)NN1C Z56822474 [0,2,0,0,0,0|2,0,0]=4 982 B8R1.18 CC1=CN(C(=O)N1)C Z1486021538 [0,2,0,0,0,0|0,0,1]=3 983 B8R1.18 CC1=NC(=C(N1)C)C Z2785909774 [0,2,0,0,0,0|0,0,0]=2 984 B8R1.18 CC1=NC(=C(S1)N)C Z951281412 [0,2,0,0,0,0|1,0,0]=3 985 B8R1.18 CC1=NC(=NN1C)N Z1198175662 [0,2,0,0,0,0|1,0,1]=4 986 B8R1.18 CC1=NN(C(=C1)N)C Z55423092 [0,2,0,0,0,0|2,0,0]=4 987 B8R1.18 CC1=NN(C(=N1)N)C Z56757682 [0,2,0,0,0,0|1,0,0]=3 988 B8R1.18 CC1=NN(C(=O)C1)C Z50146885 [0,2,0,0,0,0|2,0,0]=4 989 B8R1.18 CC1=NN(C=C1Br)C Z2235790808 [0,2,0,0,0,0|2,0,0]=4 990 B8R1.18 CC1=NN(C=C1N)C Z1742055027 [0,2,0,0,0,0|2,0,0]=4 991 B8R1.18 CC1=NN(C=C1O)C Z4131782830 [0,2,0,0,0,0|2,0,0]=4 992 B8R1.18 CC1CC(=O)NC1=O Z729209272 [0,2,0,0,0,0|1,0,1]=4 993 B8R1.18 CC1NC(=O)NC1=O Z56862247 [0,2,0,0,0,0|0,0,2]=4 994 B8R1.18 CN1C=C(C(=N1)N)Br Z763567892 [0,2,0,0,0,0|2,0,0]=4 995 B8R1.18 CN1C=C(C(=N1)N)Cl Z1188260175 [0,2,0,0,0,0|2,0,0]=4 996 B8R1.18 CN1C=C(C(=N1)N)I Z1681352115 [0,2,0,0,0,0|2,0,0]=4 997 B8R1.18 CN1C=C(C(=N1)N)N Z2106609675 [0,2,0,0,0,0|2,0,0]=4 998 B8R1.18 CN1C=C(C(=N1)O)Br Z2182014972 [0,2,0,0,0,0|2,0,0]=4 999 B8R1.18 CN1C=C(C(=N1)O)I Z3477155313 [0,2,0,0,0,0|2,0,0]=4 1000 B8R1.18 CN1C=C(C=C1N)Br Z4121492788 [0,2,0,0,0,0|2,0,0]=4 1001 B8R1.18 CN1C=C(N=C1N)O Z104500556 [0,2,0,0,0,0|1,0,0]=3 1002 B8R1.18 CN1CC(=NC1=O)N Z1203653661 [0,2,0,0,0,0|1,0,1]=4 1003 B8R1.18 CN1CC(=O)NC1=O Z104473250 [0,2,0,0,0,0|2,0,0]=4 1004 B8R1.18 CN1N=C(SC1=O)N Z1203580580 [0,2,0,0,0,0|2,0,0]=4 1005 B8R1.18 CN1NC(=O)N=C1S Z217165566 [0,2,0,0,0,0|2,0,0]=4 1006 B8R1.18 CN1NC(=O)NC1=O Z1262691921 [0,2,0,0,0,0|1,0,1]=4 1007 B8R1.50 CC1=C(C(=O)NN1)C Z1198151644 [0,2,0,0,0,0|2,0,0]=4 1008 B8R1.50 CC1=C(C(=O)NN1)N Z2205958785 [0,2,0,0,0,0|2,0,0]=4 1009 B8R1.50 CC1=C(C=NN1C)Br Z1198224382 [0,2,0,0,0,0|2,0,0]=4 1010 B8R1.50 CC1=C(C=NN1C)I Z1269221703 [0,2,0,0,0,0|2,0,0]=4 1011 B8R1.50 CC1=C(C=NN1C)N Z235263805 [0,2,0,0,0,0|2,0,0]=4 1012 B8R1.50 CC1=C(N(C=N1)C)N Z951327034 [0,2,0,0,0,0|0,0,0]=2 1013 B8R1.50 CC1=C(N(N=C1)C)N Z2106610991 [0,2,0,0,0,0|2,0,0]=4 1014 B8R1.50 CC1=C(N=NN1C)N Z2326994790 [0,2,0,0,0,0|2,0,0]=4 1015 B8R1.50 CC1=C(NN=C1N)N Z2177031148 [0,2,0,0,0,0|2,0,0]=4 1016 B8R1.50 CC1=C(SC=C1Br)Br Z1269129060 [0,2,0,0,0,0|2,0,0]=4 1017 B8R1.50 CC1=CNC(=C1C)C Z1162450215 [0,2,0,0,0,0|1,0,0]=3 1018 B8R1.50 CC1=CSC(=[N+]1C)N Z56872232 [0,2,0,0,0,0|1,0,1]=4 1019 B8R1.50 CC1=NC=C(N1C)Br Z1201623659 [0,2,0,0,0,0|2,0,0]=4 1020 B8R1.50 CC1=NC=C(N1C)N Z2310678658 [0,2,0,0,0,0|2,0,0]=4 1021 B8R1.50 CC1=NNC(=C1Br)C Z275169976 [0,2,0,0,0,0|2,0,0]=4 1022 B8R1.50 CC1=NNC(=C1Br)N Z56769169 [0,2,0,0,0,0|2,0,0]=4 1023 B8R1.50 CC1=NNC(=C1C)C Z50145985 [0,2,0,0,0,0|2,0,0]=4 1024 B8R1.50 CC1=NNC(=C1C)N Z385386488 [0,2,0,0,0,0|2,0,0]=4 1025 B8R1.50 CC1=NNC(=C1Cl)C Z3020185376 [0,2,0,0,0,0|2,0,0]=4 1026 B8R1.50 CC1=NNC(=C1N)C Z56761496 [0,2,0,0,0,0|2,0,0]=4 1027 B8R1.50 CC1=NNC(=C1O)C Z1255485863 [0,2,0,0,0,0|2,0,0]=4 1028 B8R1.50 CC1=NNC(=O)N1C Z1504678222 [0,2,0,0,0,0|1,0,1]=4 1029 B8R1.50 CC1=NOC(=C1Br)C Z372796498 [0,2,0,0,0,0|2,0,0]=4 1030 B8R1.50 CC1=NSC(=C1Cl)N Z1198261559 [0,2,0,0,0,0|2,0,0]=4 1031 B8R1.50 CC1=NSC(=C1I)C Z1783198803 [0,2,0,0,0,0|2,0,0]=4 1032 B8R1.50 CC1=NSC(=C1N)Br Z4607122944 [0,2,0,0,0,0|2,0,0]=4 1033 B8R1.50 CN1N=CC(=C1N)Br Z2238829052 [0,2,0,0,0,0|2,0,0]=4 1034 B8R1.50 CN1N=CC(=C1N)Cl Z4947384299 [0,2,0,0,0,0|2,0,0]=4 1035 B8R1.50 CN1N=CC(=C1N)F Z3409960609 [0,2,0,0,0,0|2,0,0]=4 1036 B8R1.50 CN1N=CC(=C1N)I Z1397931305 [0,2,0,0,0,0|2,0,0]=4 1037 B6R1.8 C=C1CC1CN Z3454021936 [0,0,1,1,0,0|1,0,1]=4 1038 B6R1.1 C1=CC=NC=C1 Z56899837 [0,0,1,1,0,0|1,0,1]=4 1039 B6R1.1 C1=NCCCN1 Z1198163087 [0,0,1,1,0,0|0,0,2]=4