0 B5R0.1 C=C(C)CCBr CS14513 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.1 CC(=O)\C=N\O CS11520 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CC(=O)\C=N\O CS18968 [0,0,0,0,0,0|2,0,1]=3 3 B5R0.1 CC(C)=CCBr MC41900 [0,0,0,0,0,0|1,0,1]=2 4 B5R0.1 CC(C)CC=O CS11530 [0,0,0,0,0,0|0,0,2]=2 5 B5R0.1 CC(C)SC#N MC41971 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.1 CCCC(C)=O CS21731 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.1 CN(C)CC=O CS17734 [0,0,0,0,0,0|1,0,1]=2 8 B5R0.1 CN(C)CCBr CS10949 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.1 CN(C)CCCl CS14471 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.1 CN(C)CCCl CS17225 [0,0,0,0,0,0|2,0,2]=4 11 B5R0.1 CN(C)CCN CS18603 [0,0,0,0,0,0|2,0,2]=4 12 B5R0.1 CN(C)CCO CS11733 [0,0,0,0,0,0|1,0,3]=4 13 B5R0.1 C\C=C\B(O)O MC116392 [0,0,0,0,0,0|4,0,0]=4 14 B5R0.1 C\C=C\C(=O)O MC41882 [0,0,0,0,0,0|3,0,0]=3 15 B4R0.1 C=CC(N)=O MC41857 [1,0,0,0,0,0|2,0,0]=3 16 B4R0.1 CC(=O)CBr MC20986 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.1 CC(=O)CN CS10921 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 CC(=O)CO CS11467 [1,0,0,0,0,0|1,0,2]=4 19 B4R0.1 CC(=O)NN CS10881 [1,0,0,0,0,0|3,0,0]=4 20 B4R0.1 CC(=O)NO CS14961 [1,0,0,0,0,0|2,0,1]=4 21 B4R0.1 CC(C)=NO CS10884 [1,0,0,0,0,0|1,0,1]=3 22 B4R0.1 CC(C)C#N MC41920 [1,0,0,0,0,0|1,0,2]=4 23 B4R0.1 CC(C)NN CS11525 [1,0,0,0,0,0|2,0,1]=4 24 B4R0.1 CC(C)ON CS13668 [1,0,0,0,0,0|2,0,1]=4 25 B4R0.1 CC(C)[Zn]Br MC121350 [1,0,0,0,0,0|2,0,1]=4 26 B4R0.1 C\C(N)=N\O CS10879 [1,0,0,0,0,0|2,0,1]=4 27 B4R0.1 C\C=C(/C)Br MC10255 [1,0,0,0,0,0|1,0,1]=3 28 B4R0.2 C=COCC MC41915 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.2 CCCC=O MC41868 [1,0,0,0,0,0|0,0,2]=3 30 B4R0.2 CCOC=N MC33024 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.2 CCOC=O MC41912 [1,0,0,0,0,0|1,0,1]=3 32 B4R0.2 C\C=C\C=O MC41879 [1,0,0,0,0,0|0,0,0]=1 33 B6R0.1 COC(=O)\C=C\I MC20613 [0,1,0,0,0,0|2,0,0]=3 34 B6R0.1 C\C=C\C(=O)OC MC41953 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.2 CC(=O)\C=C(/C)N MC105899 [0,1,0,0,0,0|1,0,0]=2 36 B6R0.2 CC(Br)CC(=O)O MC106689 [0,1,0,0,0,0|1,0,2]=4 37 B6R0.2 CC(C)=CC(=O)O CS14947 [0,1,0,0,0,0|0,0,0]=1 38 B6R0.2 CC(N)CC(=O)O CS19028 [0,1,0,0,0,0|1,0,2]=4 39 B6R0.2 CC(N)CC(=O)O CS20346 [0,1,0,0,0,0|1,0,2]=4 40 B6R0.2 CC(N)CC(=O)O MC439098 [0,1,0,0,0,0|1,0,2]=4 41 B6R0.2 CC(O)CC(=O)O MC426020 [0,1,0,0,0,0|1,0,2]=4 42 B6R0.2 CC(O)CC(=O)O MC426021 [0,1,0,0,0,0|1,0,2]=4 43 B6R0.2 CC(O)CC(=O)[O-] CS20253 [0,1,0,0,0,0|1,0,2]=4 44 B6R0.2 CN(C)CC(=O)O CS13413 [0,1,0,0,0,0|1,0,1]=3 45 B6R0.2 CN(C)CC(N)=S CS15155 [0,1,0,0,0,0|1,1,1]=4 46 B6R0.2 NC(=O)CC(N)=O CS11565 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.2 NC(=O)NC(N)=O CS11485 [0,1,0,0,0,0|3,0,0]=4 48 B6R0.2 O=C(O)CC(=O)O MC41922 [0,1,0,0,0,0|2,0,1]=4 49 B6R0.2 O=C(O)CC(=O)O MC41938 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.3 CN(C)C(=O)CBr CS14025 [0,1,0,0,0,0|2,0,1]=4 51 B6R0.3 CN(C)C(=O)CN CS21306 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.3 CN(C)C(=O)CN MC116188 [0,1,0,0,0,0|2,0,1]=4 53 B6R0.3 CN(C)C(=O)CN MC437713 [0,1,0,0,0,0|2,0,1]=4 54 B6R0.3 COC(=O)C(C)C MC41931 [0,1,0,0,0,0|2,0,1]=4 55 B6R0.4 C=C\C=C\C(=O)O CS12033 [0,1,0,0,0,0|3,0,0]=4 56 B6R0.4 CC(C)=CC[Mg]Cl MC116049 [0,1,0,0,0,0|1,0,1]=3 57 B6R0.4 CC(C)=CC[Zn]Cl MC116080 [0,1,0,0,0,0|1,0,1]=3 58 B6R0.4 CC(C)CCC=O MC428026 [0,1,0,0,0,0|0,0,2]=3 59 B6R0.4 CN(C)\C=C\C=O MC42238 [0,1,0,0,0,0|1,0,0]=2 60 B6R0.4 CO\C=C\C(C)=O MC33352 [0,1,0,0,0,0|1,0,1]=3 61 B6R0.5 CC(C)(C)CC=O MC20142 [0,1,0,0,0,0|0,0,2]=3 62 B6R0.5 C[Si](C)(C)C=[N+]=[N-] MC116193 [0,1,0,0,0,0|2,1,0]=4 63 B6R1.2 BrC1=CC=CS1 CS21414 [0,0,0,1,0,0|3,0,0]=4 64 B6R1.2 BrC1=CC=C[Se]1 MC114898 [0,0,0,1,0,0|3,0,0]=4 65 B6R1.2 BrC1=CC=NN1 CS17757 [0,0,0,1,0,0|3,0,0]=4 66 B6R1.2 BrC1=COC=C1 CS19877 [0,0,0,1,0,0|1,0,2]=4 67 B6R1.2 BrC1=CSC=C1 CS21415 [0,0,0,1,0,0|1,1,1]=4 68 B6R1.2 BrC1=NNC=C1 CS19717 [0,0,0,1,0,0|3,0,0]=4 69 B6R1.2 BrC1=NOC=C1 MC113742 [0,0,0,1,0,0|2,0,1]=4 70 B6R1.2 BrC1=NSC=C1 CS11529 [0,0,0,1,0,0|2,1,0]=4 71 B6R1.2 CC1=CC=CN1 CS21660 [0,0,0,1,0,0|2,0,0]=3 72 B6R1.2 CC1=CC=CO1 MC41695 [0,0,0,1,0,0|2,0,0]=3 73 B6R1.2 CC1=CC=CS1 CS21701 [0,0,0,1,0,0|2,0,0]=3 74 B6R1.2 CC1=CC=NN1 MC21108 [0,0,0,1,0,0|2,0,0]=3 75 B6R1.2 CC1=CN=CS1 CS10460 [0,0,0,1,0,0|2,0,1]=4 76 B6R1.2 CC1=CNC=C1 MC20689 [0,0,0,1,0,0|1,0,1]=3 77 B6R1.2 CC1=CNC=N1 MC20397 [0,0,0,1,0,0|2,0,1]=4 78 B6R1.2 CC1=CNN=C1 CS22982 [0,0,0,1,0,0|2,0,1]=4 79 B6R1.2 CC1=CNN=N1 CS12910 [0,0,0,1,0,0|3,0,0]=4 80 B6R1.2 CC1=COC=N1 MC427478 [0,0,0,1,0,0|1,0,2]=4 81 B6R1.2 CC1=CSC=N1 CS15621 [0,0,0,1,0,0|1,1,1]=4 82 B6R1.2 CC1=NC=CO1 CS11827 [0,0,0,1,0,0|3,0,0]=4 83 B6R1.2 CC1=NC=CS1 CS22598 [0,0,0,1,0,0|3,0,0]=4 84 B6R1.2 CC1=NCCC1 CS21664 [0,0,0,1,0,0|2,0,1]=4 85 B6R1.2 CC1=NN=CO1 CS12863 [0,0,0,1,0,0|3,0,0]=4 86 B6R1.2 CC1=NNC=C1 CS13720 [0,0,0,1,0,0|2,0,0]=3 87 B6R1.2 CC1=NNC=N1 CS22353 [0,0,0,1,0,0|3,0,0]=4 88 B6R1.2 CC1=NOC=C1 CS11533 [0,0,0,1,0,0|1,0,1]=3 89 B6R1.2 CN1C=CC=C1 CS20770 [0,0,0,1,0,0|2,0,1]=4 90 B6R1.2 CN1C=CC=N1 CS19419 [0,0,0,1,0,0|3,0,0]=4 91 B6R1.2 CN1C=CN=C1 CS19753 [0,0,0,1,0,0|2,0,1]=4 92 B6R1.2 CN1C=CN=N1 CS20743 [0,0,0,1,0,0|3,0,0]=4 93 B6R1.2 ClC1=CC=NN1 CS16937 [0,0,0,1,0,0|3,0,0]=4 94 B6R1.2 ClC1=NNC=C1 MC103128 [0,0,0,1,0,0|3,0,0]=4 95 B6R1.2 FC1=CC=NN1 MC104307 [0,0,0,1,0,0|3,0,0]=4 96 B6R1.2 IC1=CC=CS1 CS21616 [0,0,0,1,0,0|3,0,0]=4 97 B6R1.2 IC1=CSC=C1 CS22332 [0,0,0,1,0,0|1,1,1]=4 98 B6R1.2 IC1=NNC=C1 CS13669 [0,0,0,1,0,0|3,0,0]=4 99 B6R1.2 NC1=CC=NS1 MC20989 [0,0,0,1,0,0|3,0,0]=4 100 B6R1.2 NC1=CSC=C1 CS12280 [0,0,0,1,0,0|1,1,1]=4 101 B6R1.2 NC1=NNC=C1 CS22527 [0,0,0,1,0,0|3,0,0]=4 102 B6R1.2 NC1=NOC=C1 CS14368 [0,0,0,1,0,0|2,0,1]=4 103 B6R1.2 O=C1C=CNN1 MC106502 [0,0,0,1,0,0|3,0,0]=4 104 B6R1.2 O=C1C=CON1 MC442265 [0,0,0,1,0,0|2,0,1]=4 105 B6R1.2 O=C1C=CSN1 MC427073 [0,0,0,1,0,0|2,1,0]=4 106 B6R1.3 O=C=NC1CC1 MC418391 [0,0,0,1,0,0|1,0,2]=4 107 B6R1.5 NC1CC(=O)C1 MC444232 [0,0,0,1,0,0|1,0,2]=4 108 B6R1.5 O=C1CC(F)C1 MC104154 [0,0,0,1,0,0|1,0,2]=4 109 B3R0.1 C=CCBr MC41858 [2,0,0,0,0,0|1,0,1]=4 110 B3R0.1 C=C[Mg]Br MC10627 [2,0,0,0,0,0|2,0,0]=4 111 B3R0.1 C\C=C\C MC428373 [2,0,0,0,0,0|0,0,1]=3 112 B3R0.1 Cl\C=C\Cl MC41969 [2,0,0,0,0,0|2,0,0]=4 113 B3R0.2 C=C(C)Br MC440274 [2,0,0,0,0,0|1,0,0]=3 114 B3R0.2 CC(=O)Cl MC40433 [2,0,0,0,0,0|1,0,0]=3 115 B3R0.2 CC(=O)O CS19761 [2,0,0,0,0,0|1,0,0]=3 116 B3R0.2 CC(=O)[O-] CS11168 [2,0,0,0,0,0|1,0,0]=3 117 B3R0.2 CC(=O)[O-] CS11832 [2,0,0,0,0,0|1,0,0]=3 118 B3R0.2 CC(=O)[O-] MC41921 [2,0,0,0,0,0|1,0,0]=3 119 B3R0.2 CC(C)Br MC41864 [2,0,0,0,0,0|1,0,1]=4 120 B3R0.2 CC(N)=O MC40849 [2,0,0,0,0,0|1,0,0]=3 121 B3R0.2 CC(O)=S MC434055 [2,0,0,0,0,0|1,0,1]=4 122 B3R0.2 CS(=O)[O-] MC434050 [2,0,0,0,0,0|2,0,0]=4 123 B3R0.2 C[N+](=O)[O-] MC41935 [2,0,0,0,0,0|2,0,0]=4 124 B3R0.2 C[PH](C)=O MC21075 [2,0,0,0,0,0|1,0,0]=3 125 B3R0.2 O=C([O-])[O-] CS11119 [2,0,0,0,0,0|2,0,0]=4 126 B5R0.3 O=CC(=O)CO MC427604 [1,1,0,0,0,0|1,0,0]=3 127 B5R0.3 O=CC(O)CO MC107096 [1,1,0,0,0,0|1,0,1]=4 128 B5R0.3 O=CC(O)CO MC20361 [1,1,0,0,0,0|1,0,1]=4 129 B5R0.3 O=CC(O)CO MC20362 [1,1,0,0,0,0|1,0,1]=4 130 B5R0.4 CC(C)(C)C=O MC20070 [1,1,0,0,0,0|0,0,1]=3 131 B5R0.5 CC(=O)C(=O)O MC41939 [1,1,0,0,0,0|1,0,0]=3 132 B5R0.5 CC(Br)C(=O)O MC20444 [1,1,0,0,0,0|1,0,1]=4 133 B5R0.5 CC(C)C(=O)Cl MC40490 [1,1,0,0,0,0|0,0,1]=3 134 B5R0.5 CC(C)C(N)=O CS21696 [1,1,0,0,0,0|0,0,1]=3 135 B5R0.5 CC(Cl)C(=O)O MC20315 [1,1,0,0,0,0|1,0,1]=4 136 B5R0.5 CC(Cl)C(=O)O MC436860 [1,1,0,0,0,0|1,0,1]=4 137 B5R0.5 CC(F)C(=O)O MC429445 [1,1,0,0,0,0|1,0,1]=4 138 B5R0.5 CC(N)C(=O)O CS18992 [1,1,0,0,0,0|1,0,1]=4 139 B5R0.5 CC(N)C(=O)O CS19143 [1,1,0,0,0,0|1,0,1]=4 140 B5R0.5 CC(N)C(=O)O MC428047 [1,1,0,0,0,0|1,0,1]=4 141 B5R0.5 CC(N)C(N)=O CS15732 [1,1,0,0,0,0|1,0,1]=4 142 B5R0.5 CC(N)C(N)=O CS22529 [1,1,0,0,0,0|1,0,1]=4 143 B5R0.5 CC(N)C(N)=O MC436152 [1,1,0,0,0,0|1,0,1]=4 144 B5R0.5 CC(N)C(N)=O MC436153 [1,1,0,0,0,0|1,0,1]=4 145 B5R0.5 CC(O)C(=O)O MC437817 [1,1,0,0,0,0|1,0,1]=4 146 B5R0.5 CN(C)C(=O)Cl MC428263 [1,1,0,0,0,0|1,0,0]=3 147 B5R0.5 CN(C)C(N)=S MC427479 [1,1,0,0,0,0|1,1,0]=4 148 B5R0.5 NC(=O)C(N)=O MC20822 [1,1,0,0,0,0|2,0,0]=4 149 B5R0.5 O=C(O)C(=O)O CS11387 [1,1,0,0,0,0|2,0,0]=4 150 B5R0.5 O=C(O)C(=O)O MC425345 [1,1,0,0,0,0|2,0,0]=4 151 B5R0.5 O=C([O-])C(=O)[O-] MC114602 [1,1,0,0,0,0|2,0,0]=4 152 B5R0.2 C#C\C=C\CO MC428290 [1,1,0,0,0,0|1,0,1]=4 153 B5R0.2 C\C=C\C[Pd]Cl MC444919 [1,1,0,0,0,0|1,0,1]=4 154 B5R0.2 ClC\C=C\CCl MC10276 [1,1,0,0,0,0|1,0,1]=4 155 B5R0.2 ClC\C=C\CCl MC10277 [1,1,0,0,0,0|1,0,1]=4 156 B5R0.2 O=CNNC=O CS20491 [1,1,0,0,0,0|2,0,0]=4 157 B5R0.2 OC\C=C\CCl MC10262 [1,1,0,0,0,0|0,0,2]=4 158 B5R0.2 OC\C=C\CO MC41968 [1,1,0,0,0,0|0,0,2]=4 159 B5R0.2 OC\C=C\CO MC424009 [1,1,0,0,0,0|0,0,2]=4 160 B7R0.2 CC(=O)\C=C(\C)O[Rh] MC445002 [0,2,0,0,0,0|1,0,0]=3 161 B7R0.2 CC(C)OC(=O)CO CS11522 [0,2,0,0,0,0|1,0,1]=4 162 B7R0.2 CCC(=O)CC(C)=O CS21124 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.2 CCC(=O)OC(C)=O CS16382 [0,2,0,0,0,0|2,0,0]=4 164 B7R0.2 COC(=O)CC(=O)O CS13436 [0,2,0,0,0,0|1,0,1]=4 165 B7R0.2 COC(=O)CC(=O)[O-] MC41937 [0,2,0,0,0,0|1,0,1]=4 166 B7R0.2 COC(=O)CC(C)=O MC41927 [0,2,0,0,0,0|1,0,1]=4 167 B7R0.2 COC(=O)\C=C(/C)N CS13690 [0,2,0,0,0,0|1,0,0]=3 168 B7R0.2 C\C(C=O)=C/N(C)C CS22267 [0,2,0,0,0,0|1,0,0]=3 169 B7R0.3 COC(=O)CCC=O MC21172 [0,2,0,0,0,0|1,0,1]=4 170 B7R0.3 COC(=O)\C=C\CBr CS13509 [0,2,0,0,0,0|2,0,0]=4 171 B7R0.3 CO\C=C\C(=O)OC CS11630 [0,2,0,0,0,0|1,0,1]=4 172 B7R0.9 CC(C)(C)CC(=O)O CS22814 [0,2,0,0,0,0|0,0,2]=4 173 B7R0.9 CC(C)(C)OC(N)=O CS11993 [0,2,0,0,0,0|1,0,1]=4 174 B7R0.9 CC(C)(N)CC(=O)O CS14805 [0,2,0,0,0,0|0,0,2]=4 175 B7R0.9 CC(C)(N)CC(=O)O CS17039 [0,2,0,0,0,0|0,0,2]=4 176 B7R0.9 C[N+](C)(C)CC(=O)O MC34237 [0,2,0,0,0,0|1,0,1]=4 177 B7R0.9 C[N+](C)(C)CC(=O)[O-] MC34236 [0,2,0,0,0,0|1,0,1]=4 178 B7R0.16 CC(C)C(=O)C(=O)[O-] CS22357 [0,2,0,0,0,0|0,0,1]=3 179 B7R0.16 CC(C)C(Br)C(=O)O MC431184 [0,2,0,0,0,0|0,0,2]=4 180 B7R0.16 CC(C)C(Cl)C(=O)O MC426014 [0,2,0,0,0,0|0,0,2]=4 181 B7R0.16 CC(C)C(F)C(=O)O MC429818 [0,2,0,0,0,0|0,0,2]=4 182 B7R0.16 CC(C)C(N)C(=O)O CS19285 [0,2,0,0,0,0|0,0,2]=4 183 B7R0.16 CC(C)C(N)C(=O)O MC438291 [0,2,0,0,0,0|0,0,2]=4 184 B7R0.16 CC(C)C(N)C(=O)O MC438292 [0,2,0,0,0,0|0,0,2]=4 185 B7R0.16 CC(C)C(N)C(N)=O CS11445 [0,2,0,0,0,0|0,0,2]=4 186 B7R0.16 CC(C)C(N)C(N)=O MC428367 [0,2,0,0,0,0|0,0,2]=4 187 B7R0.16 CC(C)C(N)C(N)=O MC435294 [0,2,0,0,0,0|0,0,2]=4 188 B7R0.16 CC(C)C(O)C(=O)O MC437769 [0,2,0,0,0,0|0,0,2]=4 189 B7R0.16 CC(C)C(O)C(=O)O MC437770 [0,2,0,0,0,0|0,0,2]=4 190 B7R0.16 CN(C)C(=O)C(=O)O CS11735 [0,2,0,0,0,0|1,0,0]=3 191 B7R0.4 CCC\C=C\C(C)=O MC20875 [0,2,0,0,0,0|2,0,0]=4 192 B7R0.6 C=C(C)CCC(=O)O CS16527 [0,2,0,0,0,0|0,0,2]=4 193 B7R0.6 CC(=O)CCC(=O)O CS18688 [0,2,0,0,0,0|1,0,1]=4 194 B7R0.6 CC(=O)NCC(=O)O CS19131 [0,2,0,0,0,0|1,0,1]=4 195 B7R0.6 CC(C)CCC(=O)Cl MC20895 [0,2,0,0,0,0|0,0,2]=4 196 B7R0.6 CN(C)CCC(=O)O CS12169 [0,2,0,0,0,0|1,0,1]=4 197 B5R1.3 C=CC1CO1 MC428261 [1,0,0,1,0,0|1,0,1]=4 198 B5R1.3 O=CC1CC1 MC428327 [1,0,0,1,0,0|0,0,1]=3 199 B5R1.1 C1=CCNC1 MC10278 [1,0,0,1,0,0|1,0,1]=4 200 B5R1.1 C1=CNC=C1 MC20798 [1,0,0,1,0,0|1,0,1]=4 201 B5R1.1 C1=CNN=C1 CS18933 [1,0,0,1,0,0|2,0,0]=4 202 B5R1.1 C1=CON=C1 MC20462 [1,0,0,1,0,0|1,0,1]=4 203 B5R1.1 C1=CSC=C1 MC41709 [1,0,0,1,0,0|0,1,1]=4 204 B5R1.1 C1=CSN=C1 MC20995 [1,0,0,1,0,0|1,1,0]=4 205 B5R1.1 C1=C[CH-]C=C1 MC21078 [1,0,0,1,0,0|1,0,1]=4 206 B7R1.1 BrCC1=CC=CS1 MC111260 [0,1,0,1,0,0|2,0,0]=4 207 B7R1.1 BrCC1=CC=NO1 MC114075 [0,1,0,1,0,0|2,0,0]=4 208 B7R1.1 BrCC1=COC=C1 MC111404 [0,1,0,1,0,0|0,0,2]=4 209 B7R1.1 COC1=CSC=C1 CS22351 [0,1,0,1,0,0|0,1,1]=4 210 B7R1.1 ClCC1=CC=CO1 CS13429 [0,1,0,1,0,0|2,0,0]=4 211 B7R1.1 ClCC1=NNC=C1 MC442276 [0,1,0,1,0,0|2,0,0]=4 212 B7R1.1 NCC1=CC=CN1 CS14874 [0,1,0,1,0,0|2,0,0]=4 213 B7R1.1 NCC1=CC=CO1 MC41689 [0,1,0,1,0,0|2,0,0]=4 214 B7R1.1 NCC1=CC=CS1 CS22783 [0,1,0,1,0,0|2,0,0]=4 215 B7R1.1 NCC1=CSC=C1 CS22417 [0,1,0,1,0,0|0,1,1]=4 216 B7R1.1 NCC1=NNC=C1 CS15493 [0,1,0,1,0,0|2,0,0]=4 217 B7R1.1 NCC1=NSC=C1 MC105065 [0,1,0,1,0,0|1,1,0]=4 218 B7R1.1 OCC1=CC=CO1 MC41687 [0,1,0,1,0,0|2,0,0]=4 219 B7R1.1 OCC1=CC=NO1 CS15343 [0,1,0,1,0,0|2,0,0]=4 220 B7R1.1 OCC1=COC=C1 CS22303 [0,1,0,1,0,0|0,0,2]=4 221 B7R1.1 OCC1=CSC=C1 CS18039 [0,1,0,1,0,0|0,1,1]=4 222 B7R1.2 CC1=CC(=O)CC1 CS22356 [0,1,0,1,0,0|0,0,0]=2 223 B7R1.2 CC1=CC(=O)CO1 MC429080 [0,1,0,1,0,0|0,0,0]=2 224 B7R1.2 CC1=CC(=O)NN1 CS22601 [0,1,0,1,0,0|1,0,0]=3 225 B7R1.2 CC1=CC(Br)=CS1 CS22736 [0,1,0,1,0,0|1,0,1]=4 226 B7R1.2 CC1=CC(Br)=NN1 CS12832 [0,1,0,1,0,0|2,0,0]=4 227 B7R1.2 CC1=CC(Br)=NO1 MC113406 [0,1,0,1,0,0|2,0,0]=4 228 B7R1.2 CC1=CC(C)=NN1 CS19982 [0,1,0,1,0,0|2,0,0]=4 229 B7R1.2 CC1=CC(C)=NO1 CS14107 [0,1,0,1,0,0|1,0,1]=4 230 B7R1.2 CC1=CC(I)=NN1 CS16887 [0,1,0,1,0,0|2,0,0]=4 231 B7R1.2 CC1=CC=C(Br)S1 CS22735 [0,1,0,1,0,0|2,0,0]=4 232 B7R1.2 CC1=CC=C(C)N1 CS21153 [0,1,0,1,0,0|2,0,0]=4 233 B7R1.2 CC1=CN=C(Br)S1 CS12301 [0,1,0,1,0,0|2,0,0]=4 234 B7R1.2 CC1=CN=C(C)S1 CS22782 [0,1,0,1,0,0|2,0,0]=4 235 B7R1.2 CC1=CN=C(N)S1 CS21821 [0,1,0,1,0,0|2,0,0]=4 236 B7R1.2 CC1=CNC(Br)=N1 MC111806 [0,1,0,1,0,0|2,0,0]=4 237 B7R1.2 CC1=CNC(C)=N1 CS21117 [0,1,0,1,0,0|2,0,0]=4 238 B7R1.2 CC1=COC(Br)=N1 MC113513 [0,1,0,1,0,0|2,0,0]=4 239 B7R1.2 CC1=CSC(Br)=N1 CS18300 [0,1,0,1,0,0|2,0,0]=4 240 B7R1.2 CC1=CSC(C)=N1 CS22781 [0,1,0,1,0,0|2,0,0]=4 241 B7R1.2 CC1=CSC(N)=C1 MC113026 [0,1,0,1,0,0|0,1,1]=4 242 B7R1.2 CC1=CSC(N)=C1 MC121228 [0,1,0,1,0,0|0,1,1]=4 243 B7R1.2 CC1=NC(I)=CS1 MC432141 [0,1,0,1,0,0|2,0,0]=4 244 B7R1.2 CC1=NC=C(I)N1 CS19295 [0,1,0,1,0,0|2,0,0]=4 245 B7R1.2 CC1=NC=C(I)S1 MC441133 [0,1,0,1,0,0|2,0,0]=4 246 B7R1.2 CC1=NC=C(N)N1 MC445566 [0,1,0,1,0,0|2,0,0]=4 247 B7R1.2 CC1=NC=C(N)S1 CS15937 [0,1,0,1,0,0|2,0,0]=4 248 B7R1.2 CC1=NN(C)C=C1 CS20520 [0,1,0,1,0,0|2,0,0]=4 249 B7R1.2 CC1=NNC(=O)C1 CS16242 [0,1,0,1,0,0|1,0,0]=3 250 B7R1.2 CC1=NNC(=O)O1 CS10427 [0,1,0,1,0,0|2,0,0]=4 251 B7R1.2 CC1=NNC(=O)S1 MC107311 [0,1,0,1,0,0|2,0,0]=4 252 B7R1.2 CC1=NOC(N)=C1 CS16239 [0,1,0,1,0,0|1,0,1]=4 253 B7R1.2 CC1=NSC(=O)O1 MC42245 [0,1,0,1,0,0|2,0,0]=4 254 B7R1.2 CC1=NSC(Br)=C1 CS10288 [0,1,0,1,0,0|1,1,0]=4 255 B7R1.2 CC1=NSC(I)=C1 MC100265 [0,1,0,1,0,0|1,1,0]=4 256 B7R1.2 CC1=NSC(N)=C1 CS16387 [0,1,0,1,0,0|1,1,0]=4 257 B7R1.2 CC1COC(=O)N1 CS14300 [0,1,0,1,0,0|1,0,1]=4 258 B7R1.2 CC1COC(=O)O1 MC428298 [0,1,0,1,0,0|1,0,1]=4 259 B7R1.2 CN1C=CC(=O)N1 CS17197 [0,1,0,1,0,0|2,0,0]=4 260 B7R1.2 CN1CCC(=O)C1 CS20760 [0,1,0,1,0,0|1,0,1]=4 261 B7R1.2 NC1=CC(=O)NN1 CS13152 [0,1,0,1,0,0|2,0,0]=4 262 B7R1.2 NC1=NCC(=O)N1 MC102809 [0,1,0,1,0,0|2,0,0]=4 263 B7R1.2 NC1=NNC(=O)C1 CS14532 [0,1,0,1,0,0|2,0,0]=4 264 B7R1.2 O=C1C=C(Br)CN1 MC431199 [0,1,0,1,0,0|1,0,0]=3 265 B7R1.2 O=C1C=C(Br)CN1 MC431360 [0,1,0,1,0,0|1,0,0]=3 266 B7R1.2 O=C1CCC(=O)N1 MC41707 [0,1,0,1,0,0|2,0,0]=4 267 B7R1.2 O=C1CNC(=O)C1 MC116520 [0,1,0,1,0,0|1,0,1]=4 268 B7R1.2 O=C1CNC(=S)N1 MC427395 [0,1,0,1,0,0|2,0,0]=4 269 B7R1.2 O=C1CSC(=O)N1 CS22526 [0,1,0,1,0,0|2,0,0]=4 270 B7R1.3 CC1=CC=CN=C1 MC107850 [0,1,0,1,0,0|1,0,1]=4 271 B7R1.3 CC1=CC=CN=N1 CS22374 [0,1,0,1,0,0|2,0,0]=4 272 B7R1.3 CC1=CC=NC=C1 MC31239 [0,1,0,1,0,0|1,0,1]=4 273 B7R1.3 CC1=CC=NC=C1 MC41625 [0,1,0,1,0,0|1,0,1]=4 274 B7R1.3 CC1=CN=CN=C1 CS18851 [0,1,0,1,0,0|1,0,1]=4 275 B7R1.3 CC1=CN=NC=C1 CS22983 [0,1,0,1,0,0|1,0,1]=4 276 B7R1.3 CC1=NC=CC=C1 MC41623 [0,1,0,1,0,0|1,0,1]=4 277 B7R1.3 CC1=NC=NC=C1 CS19795 [0,1,0,1,0,0|1,0,1]=4 278 B7R1.3 CN1CC=CCC1 CS20742 [0,1,0,1,0,0|2,0,0]=4 279 B7R1.3 O=C1C=CCCC1 MC41883 [0,1,0,1,0,0|2,0,0]=4 280 B7R1.3 O=C1C=CCCN1 CS15771 [0,1,0,1,0,0|2,0,0]=4 281 B7R1.3 O=C1C=CCOC1 CS17023 [0,1,0,1,0,0|1,0,1]=4 282 B7R1.4 CC1=C(Br)C=NN1 CS16927 [0,1,0,1,0,0|2,0,0]=4 283 B7R1.4 CC1=C(Br)SC=C1 CS13700 [0,1,0,1,0,0|0,1,1]=4 284 B7R1.4 CC1=C(C)NC=N1 MC20435 [0,1,0,1,0,0|2,0,0]=4 285 B7R1.4 CC1=C(C)SC=N1 CS22784 [0,1,0,1,0,0|1,1,0]=4 286 B7R1.4 CC1=CC=NN1C CS19266 [0,1,0,1,0,0|1,0,0]=3 287 B7R1.4 CC1=CNN=C1C CS13346 [0,1,0,1,0,0|2,0,0]=4 288 B7R1.4 CC1=CSC=C1Br MC441134 [0,1,0,1,0,0|0,1,1]=4 289 B7R1.4 CC1=CSC=C1N MC427269 [0,1,0,1,0,0|0,1,1]=4 290 B7R1.4 CC1=NNC=C1Br CS15947 [0,1,0,1,0,0|2,0,0]=4 291 B7R1.4 CC1=NNC=C1I CS22358 [0,1,0,1,0,0|2,0,0]=4 292 B7R1.4 CC1=NOC=C1N CS17073 [0,1,0,1,0,0|1,0,1]=4 293 B7R1.4 CC1=NSC=C1Br MC100263 [0,1,0,1,0,0|1,1,0]=4 294 B7R1.4 CN1N=CC=C1Br CS12124 [0,1,0,1,0,0|2,0,0]=4 295 B7R1.4 CN1N=CC=C1N CS22609 [0,1,0,1,0,0|2,0,0]=4 296 B7R1.4 CN1N=CC=C1O CS10399 [0,1,0,1,0,0|2,0,0]=4 297 B7R1.4 O=C1CCC=C1O CS14654 [0,1,0,1,0,0|2,0,0]=4 298 B7R1.6 COC=C1COC1 MC113188 [0,1,0,1,0,0|2,0,0]=4 299 B7R1.6 N#CC=C1COC1 MC102286 [0,1,0,1,0,0|1,0,1]=4 300 B7R1.6 N#CC=C1COC1 MC102287 [0,1,0,1,0,0|1,0,1]=4 301 B7R1.10 NCC1CC(=O)C1 MC444212 [0,1,0,1,0,0|0,0,2]=4 302 B7R1.10 NCC1CC(=O)N1 MC111758 [0,1,0,1,0,0|1,0,1]=4 303 B7R1.10 O=C1CC(CI)N1 MC111759 [0,1,0,1,0,0|1,0,1]=4 304 B7R1.10 O=C1CC(CO)C1 MC113039 [0,1,0,1,0,0|0,0,2]=4 305 B7R1.12 CC1CC1C(=O)O MC100841 [0,1,0,1,0,0|0,0,2]=4 306 B7R1.12 CC1CC1C(=O)O MC103281 [0,1,0,1,0,0|0,0,2]=4 307 B7R1.12 CC1CC1C(N)=O MC425328 [0,1,0,1,0,0|0,0,2]=4 308 B7R1.20 O=C(O)CC1CC1 MC433946 [0,1,0,1,0,0|0,0,2]=4