0 B9R1.3 Cc1c(c(ncn1)N)N FS009370 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.3 Cc1cccc(c1F)Br FS007309 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.3 Cc1ccnc(c1N)F FS007053 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.3 c1c(c(c(cn1)Br)N)N FS001030 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.3 c1c(c(c(cn1)Cl)N)N FS001029 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.3 c1cc(c(c(c1)I)F)O FS007926 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.3 c1cc(c(c(c1)O)F)N FS009406 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.3 c1cnc(c(c1N)N)Br FS007637 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.4 C[n+]1cccc(c1)Br FS003003 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.4 Cc1cc(ccn1)Br FS061083 [1,0,0,0,0,0|2,0,0]=3 10 B8R1.4 Cc1cc(nnc1)O FS007939 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.4 c1c(cncc1F)N FS001110 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.4 c1cnc(cc1Br)Br FS001026 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.4 c1cnc(cc1Br)Cl FS410162 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.4 c1cnc(cc1Br)N FS001007 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.4 c1cnc(cc1Cl)N FS001111 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.4 c1cnc(cc1N)Cl FS000027 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.5 Cc1ccnnc1O FS009161 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.5 c1cc(c(nc1)F)Br FS001113 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.5 c1cc(c(nc1)S)O FS007365 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.5 c1cncc(c1N)I FS002088 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.2 COc1cccc(c1Br)F FS008005 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.2 COc1cccc(c1F)Br FS007289 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.2 Cc1c(c(ccn1)C=O)O FS005103 [0,1,0,0,0,0|1,0,1]=3 24 B10R1.2 Cc1c(cccc1[Zn]Br)Cl FS430026 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.2 Cc1c(cccc1[Zn]Br)Cl FS430532 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.2 Cc1cccc(c1C)[Zn]Br FS430082 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.2 Cc1cccc(c1C)[Zn]Br FS430583 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.2 Cc1cccc(c1Cl)[Mg]Br FS410192 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.2 Cc1cccc(c1Cl)[Mg]Br FS420187 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.2 Cc1cccc(c1Cl)[Zn]Br FS430319 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.2 Cc1cccc(c1Cl)[Zn]Br FS430823 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.2 c1cc(c(c(c1)Cl)Cl)[Mg]Br FS410178 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.2 c1cc(c(c(c1)Cl)Cl)[Mg]Br FS420173 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.2 c1cc(c(c(c1)[Mg]Br)Cl)F FS410191 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.2 c1cc(c(c(c1)[Mg]Br)Cl)F FS420186 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.2 c1cc(c(c(c1)[Zn]Br)Cl)Cl FS430308 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.2 c1cc(c(c(c1)[Zn]Br)Cl)Cl FS430812 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.2 c1cc(c(c(c1)[Zn]Br)Cl)F FS430318 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.2 c1cc(c(c(c1)[Zn]Br)Cl)F FS430822 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.2 c1cc(c(c(c1)[Zn]Br)F)F FS430381 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.2 c1cc(c(c(c1)[Zn]Br)F)F FS430878 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.2 c1cnc(c(c1CCl)F)Br FS023204 [0,1,0,0,0,0|3,0,0]=4 43 B10R1.22 Cc1cc(c(c(c1)Br)F)O FS007922 [0,1,0,0,0,0|3,0,0]=4 44 B10R1.22 Cc1cc(nc(c1Br)C)C FS009348 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.119 Cc1c(ccc(c1F)F)O FS010291 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.119 Cc1c(ccc(c1O)F)F FS008055 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.119 Cn1ccc(=O)c(c1Br)F FS023203 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.119 c1cc(c(c(c1F)F)O)Br FS008050 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.119 c1cc(c(c(c1F)O)F)Br FS007916 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.119 c1cc(c(c(c1N)O)F)F FS009000 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.245 Cc1cccc(c1OC)O FS010289 [0,1,0,0,0,0|1,0,0]=2 52 B10R1.245 Cc1cccc(c1[Mg]Br)Cl FS410188 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.245 Cc1cccc(c1[Mg]Br)Cl FS420183 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.245 Cc1cccc(c1[Zn]Br)C FS430085 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.245 Cc1cccc(c1[Zn]Br)C FS430586 [0,1,0,0,0,0|1,0,0]=2 56 B10R1.245 Cc1cccc(c1[Zn]Br)Cl FS430315 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.245 Cc1cccc(c1[Zn]Br)Cl FS430819 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.245 c1cc(c(c(c1)Br)C#N)O FS008057 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.245 c1cc(c(c(c1)Cl)[Zn]Br)Cl FS430307 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.245 c1cc(c(c(c1)Cl)[Zn]Br)Cl FS430811 [0,1,0,0,0,0|3,0,0]=4 61 B7R1.3 Cc1ccnnc1 FS009182 [2,0,0,0,0,0|2,0,0]=4 62 B7R1.3 c1cnncc1O FS009166 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.2 C#Cc1cccc(c1)N FS000012 [1,1,0,0,0,0|1,0,1]=4 64 B9R1.2 CCc1cc(ccn1)Br FS009511 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.2 CCc1cccc(n1)Br FS009138 [1,1,0,0,0,0|2,0,0]=4 66 B9R1.2 Cc1cc(ccn1)[Mg]Br FS410299 [1,1,0,0,0,0|2,0,0]=4 67 B9R1.2 Cc1cc(ccn1)[Mg]Br FS420294 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.2 Cc1cc(cnc1)[Zn]Br FS430179 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.2 Cc1cc(cnc1)[Zn]Br FS430678 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.2 Cc1cccc(c1)[Zn]Br FS430173 [1,1,0,0,0,0|1,0,0]=3 71 B9R1.2 Cc1cccc(c1)[Zn]Br FS430672 [1,1,0,0,0,0|1,0,0]=3 72 B9R1.2 Cc1ccnc(c1)[Zn]Br FS430178 [1,1,0,0,0,0|2,0,0]=4 73 B9R1.2 c1c(cncc1Cl)CO FS001092 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.2 c1cc(cc(c1)Br)CN FS000883 [1,1,0,0,0,0|1,0,0]=3 75 B9R1.2 c1cc(cc(c1)I)CO FS000603 [1,1,0,0,0,0|1,0,0]=3 76 B9R1.2 c1cc(cc(c1)[Zn]Br)Cl FS430540 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.34 Cc1cc(cc(n1)C)Br FS001052 [1,1,0,0,0,0|1,0,0]=3 78 B9R1.34 c1c(cc(cc1F)I)O FS010922 [1,1,0,0,0,0|2,0,0]=4 79 B9R1.69 Cc1c(ccc(n1)Cl)Br FS001025 [1,1,0,0,0,0|2,0,0]=4 80 B9R1.69 Cc1cc(ccc1I)Br FS000030 [1,1,0,0,0,0|1,0,0]=3 81 B9R1.69 Cc1cc(ncc1F)Cl FS007139 [1,1,0,0,0,0|2,0,0]=4 82 B9R1.69 Cc1cc(ncc1N)F FS007140 [1,1,0,0,0,0|2,0,0]=4 83 B9R1.69 Cc1ccc(c(n1)Br)I FS008036 [1,1,0,0,0,0|2,0,0]=4 84 B9R1.69 Cc1ccc(c(n1)C)Br FS001028 [1,1,0,0,0,0|1,0,0]=3 85 B9R1.69 c1cc(c(cc1F)Cl)I FS011367 [1,1,0,0,0,0|2,0,0]=4 86 B9R1.69 c1cc(c(cc1I)O)F FS008064 [1,1,0,0,0,0|2,0,0]=4 87 B9R1.15 CCc1ccncc1Br FS007509 [1,1,0,0,0,0|2,0,0]=4 88 B9R1.15 CCc1ccncc1N FS009315 [1,1,0,0,0,0|2,0,0]=4 89 B9R1.15 COc1cccnc1S FS007350 [1,1,0,0,0,0|1,1,0]=4 90 B9R1.15 Cc1c(cccn1)[Zn]Br FS430677 [1,1,0,0,0,0|2,0,0]=4 91 B9R1.15 Cc1ccccc1[Zn]Br FS430172 [1,1,0,0,0,0|1,0,0]=3 92 B9R1.15 Cc1ccccc1[Zn]Br FS430671 [1,1,0,0,0,0|1,0,0]=3 93 B9R1.15 c1ccc(c(c1)C#N)I FS011377 [1,1,0,0,0,0|1,0,1]=4 94 B9R1.15 c1ccc(c(c1)CN)Br FS000826 [1,1,0,0,0,0|1,0,0]=3 95 B9R1.15 c1ccc(c(c1)[Mg]Br)Cl FS410177 [1,1,0,0,0,0|2,0,0]=4 96 B9R1.15 c1ccc(c(c1)[Mg]Br)Cl FS420172 [1,1,0,0,0,0|2,0,0]=4 97 B9R1.15 c1cncc(c1Cl)CO FS001091 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.13 Cc1cccc(c1F)C[Mg]Br FS410046 [0,2,0,0,0,0|1,0,0]=3 99 B11R1.13 Cc1cccc(c1F)C[Mg]Br FS420042 [0,2,0,0,0,0|1,0,0]=3 100 B11R1.13 Cc1cccc(c1F)C[Zn]Br FS430104 [0,2,0,0,0,0|1,0,0]=3 101 B11R1.13 Cc1cccc(c1F)C[Zn]Br FS430604 [0,2,0,0,0,0|1,0,0]=3 102 B11R1.13 c1cc(c(c(c1)Cl)F)C[Zn]Br FS430014 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.13 c1cc(c(c(c1)Cl)F)C[Zn]Br FS430520 [0,2,0,0,0,0|2,0,0]=4 104 B11R1.13 c1cc(c(c(c1)F)F)C[Zn]Br FS430051 [0,2,0,0,0,0|2,0,0]=4 105 B11R1.13 c1cc(c(c(c1)F)F)C[Zn]Br FS430557 [0,2,0,0,0,0|2,0,0]=4 106 B11R1.72 COc1c(ccc(c1F)F)O FS008051 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.72 COc1c(ccc(c1O)F)Br FS007917 [0,2,0,0,0,0|1,0,0]=3 108 B11R1.159 B(c1cccc(c1F)C)(O)O FS009385 [0,2,0,0,0,0|2,0,0]=4 109 B11R1.159 CC(=O)c1cccc(c1F)Br FS005071 [0,2,0,0,0,0|2,0,0]=4 110 B11R1.159 CC(c1cccc(c1F)Br)O FS010040 [0,2,0,0,0,0|2,0,0]=4 111 B11R1.159 c1cc(c(c(c1)Br)F)C(F)F FS009913 [0,2,0,0,0,0|2,0,0]=4 112 B11R1.265 COc1c(cccc1[Zn]Br)F FS430234 [0,2,0,0,0,0|2,0,0]=4 113 B11R1.265 COc1c(cccc1[Zn]Br)F FS430737 [0,2,0,0,0,0|2,0,0]=4 114 B11R1.265 Cc1cccc(c1OC)[Mg]Br FS410269 [0,2,0,0,0,0|1,0,0]=3 115 B11R1.265 Cc1cccc(c1OC)[Mg]Br FS420264 [0,2,0,0,0,0|1,0,0]=3 116 B11R1.265 Cc1cccc(c1OC)[Zn]Br FS430342 [0,2,0,0,0,0|1,0,0]=3 117 B11R1.265 Cc1cccc(c1OC)[Zn]Br FS430846 [0,2,0,0,0,0|1,0,0]=3 118 B11R1.278 COc1ccc(c(c1O)F)Br FS008059 [0,2,0,0,0,0|1,0,0]=3 119 B11R1.14 Cc1cc(cc(c1Cl)C)[Zn]Br FS430012 [0,2,0,0,0,0|1,0,0]=3 120 B11R1.14 Cc1cc(cc(c1Cl)C)[Zn]Br FS430518 [0,2,0,0,0,0|1,0,0]=3 121 B11R1.14 Cc1cc(cc(c1F)C)[Zn]Br FS430077 [0,2,0,0,0,0|1,0,0]=3 122 B11R1.14 Cc1cc(cc(c1F)C)[Zn]Br FS430578 [0,2,0,0,0,0|1,0,0]=3 123 B11R1.464 COc1c(cc(cc1Br)F)F FS000354 [0,2,0,0,0,0|2,0,0]=4 124 B11R1.464 COc1c(cc(cc1Br)F)O FS007923 [0,2,0,0,0,0|2,0,0]=4 125 B11R1.464 COc1c(cc(cc1F)F)O FS010310 [0,2,0,0,0,0|2,0,0]=4 126 B11R1.605 CCOc1c(cccc1Br)F FS007641 [0,2,0,0,0,0|2,0,0]=4 127 B11R1.605 Cc1cccc(c1C[Zn]Cl)C FS430073 [0,2,0,0,0,0|1,0,0]=3 128 B11R2.106 Cc1cccc2c1scc2 FS002055 [0,1,0,1,0,0|0,1,1]=4 129 B11R2.106 c1cc2c(c(c1)O)OCC2 FS010290 [0,1,0,1,0,0|1,0,0]=3 130 B7R1.4 Cc1c(nc[nH]1)C FS001690 [1,0,0,0,1,0|2,0,0]=4 131 B7R1.4 Cc1c(nc[nH]1)C FS001691 [1,0,0,0,1,0|2,0,0]=4