0 B12R2.100 c1c[nH]c2c1cc(c(c2)Cl)F H61351 [1,0,0,0,0,0|2,1,0]=4 1 B12R2.132 Cc1csc2c1cc(cc2)Cl A11827 [1,0,0,0,0,0|2,1,0]=4 2 B12R2.132 c1cc2c(cc1Br)c(n[nH]2)N H33351 [1,0,0,0,0,0|2,1,0]=4 3 B12R2.132 c1cc2c(cc1Cl)c(n[nH]2)Cl H33220 [1,0,0,0,0,0|2,0,0]=3 4 B12R2.132 c1cc2c(cc1I)c(n[nH]2)N H34227 [1,0,0,0,0,0|2,1,0]=4 5 B12R2.612 c1cc2c(cc1Br)[nH]nc2N H34095 [1,0,0,0,0,0|2,1,0]=4 6 B12R2.612 c1cc2c(cc1Cl)CCC2=O A18308 [1,0,0,0,0,0|2,0,1]=4 7 B12R2.612 c1cc2c(cc1N)[nH]nc2Cl H61445 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.612 c1cc2c(cc1O)OCC2=O L10951 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.232 c1c(c(cc(c1Br)O)O)C(=O)O A18230 [0,0,1,0,0,0|2,1,0]=4 10 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O B22064 [0,0,1,0,0,0|2,1,0]=4 11 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O H55521 [0,0,1,0,0,0|2,1,0]=4 12 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl A18740 [0,0,1,0,0,0|2,0,1]=4 13 B12R1.367 COC(=O)c1ccc(c(c1)Cl)Cl B20027 [0,0,1,0,0,0|2,0,1]=4 14 B12R1.367 c1cc(c(cc1C(=O)CBr)Cl)Cl A13365 [0,0,1,0,0,0|2,0,1]=4 15 B12R1.367 c1cc(c(cc1C(=O)CCl)Cl)Cl B25397 [0,0,1,0,0,0|2,0,1]=4 16 B12R1.367 c1cc(c(cc1\C(=N\O)\N)F)F H54636 [0,0,1,0,0,0|1,2,0]=4 17 B12R1.367 c1cc(c(cc1\C(=N\O)\N)N)N H66495 [0,0,1,0,0,0|3,0,0]=4 18 B12R1.367 c1cc(c(cc1\C(=N\O)\N)O)O H54311 [0,0,1,0,0,0|3,0,0]=4 19 B12R1.385 c1cc(c(cc1CN=C=S)Cl)Cl L11701 [0,0,1,0,0,0|1,1,1]=4 20 B14R2.28472 Cc1cc2c(cc1Cl)c(=O)cco2 H26997 [0,0,0,0,0,1|2,0,1]=4 21 B11R1.21 B(c1ccc(c(c1)C)Cl)(O)O B23179 [1,0,1,0,0,0|2,0,0]=4 22 B11R1.21 B(c1ccc(c(c1)Cl)C)(O)O H28288 [1,0,1,0,0,0|2,0,0]=4 23 B11R1.21 B(c1ccc(c(c1)Cl)Cl)(O)O B24292 [1,0,1,0,0,0|1,0,0]=3 24 B11R1.21 B(c1ccc(c(c1)Cl)F)(O)O B22755 [1,0,1,0,0,0|1,1,0]=4 25 B11R1.21 B(c1ccc(c(c1)F)Cl)(O)O H53325 [1,0,1,0,0,0|1,1,0]=4 26 B11R1.21 B(c1ccc(c(c1)N)Cl)(O)O H52893 [1,0,1,0,0,0|2,0,0]=4 27 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl A13568 [1,0,1,0,0,0|1,0,1]=4 28 B11R1.21 Cc1cc(ccc1Cl)C(=O)O L08533 [1,0,1,0,0,0|1,0,1]=4 29 B11R1.21 Cc1ccc(cc1Cl)C(=O)O B21228 [1,0,1,0,0,0|1,0,1]=4 30 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O B25586 [1,0,1,0,0,0|1,0,1]=4 31 B11R1.21 c1cc(c(cc1C(=O)Cl)Cl)Cl A17006 [1,0,1,0,0,0|1,0,1]=4 32 B11R1.21 c1cc(c(cc1C(=O)N)Cl)Cl A13878 [1,0,1,0,0,0|0,0,2]=4 33 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl L19244 [1,0,1,0,0,0|0,1,1]=4 34 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Br H27252 [1,0,1,0,0,0|0,1,1]=4 35 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Cl A15873 [1,0,1,0,0,0|0,0,1]=3 36 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F A12814 [1,0,1,0,0,0|0,1,1]=4 37 B11R1.21 c1cc(c(cc1C(=O)O)Cl)N H55590 [1,0,1,0,0,0|1,0,1]=4 38 B11R1.21 c1cc(c(cc1C(=O)O)Cl)O A12134 [1,0,1,0,0,0|1,0,1]=4 39 B11R1.21 c1cc(c(cc1C(=O)O)F)Cl H26161 [1,0,1,0,0,0|0,1,1]=4 40 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl H33513 [1,0,1,0,0,0|0,1,1]=4 41 B11R1.21 c1cc(c(cc1C(=O)O)N)Cl A12671 [1,0,1,0,0,0|1,0,1]=4 42 B11R1.21 c1cc(c(cc1C(=S)N)Cl)Cl H34280 [1,0,1,0,0,0|0,1,1]=4 43 B11R1.21 c1cc(nc(c1Cl)Cl)C(=O)O H64320 [1,0,1,0,0,0|1,0,1]=4 44 B11R1.166 CC(=O)c1ccc(cc1O)Cl H27309 [1,0,1,0,0,0|1,0,1]=4 45 B11R1.166 Cc1cc(ccc1C(=O)O)Cl H27262 [1,0,1,0,0,0|2,0,0]=4 46 B11R1.166 Cc1ccc(c(c1)O)C(=O)O L03367 [1,0,1,0,0,0|2,0,0]=4 47 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O H59777 [1,0,1,0,0,0|2,0,0]=4 48 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O A12372 [1,0,1,0,0,0|2,0,0]=4 49 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O B25277 [1,0,1,0,0,0|2,0,0]=4 50 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O A10201 [1,0,1,0,0,0|2,0,0]=4 51 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O B22520 [1,0,1,0,0,0|1,0,0]=3 52 B11R1.166 c1cc(c(cc1F)O)C(=O)O B24992 [1,0,1,0,0,0|1,1,0]=4 53 B11R1.166 c1cc(c(cc1N)O)C(=O)O B23289 [1,0,1,0,0,0|2,0,0]=4 54 B11R1.166 c1cc(c(cc1O)O)C(=O)O A13545 [1,0,1,0,0,0|2,0,0]=4 55 B11R1.167 B(c1cc(ccc1O)Cl)(O)O H53075 [1,0,1,0,0,0|2,0,0]=4 56 B11R1.167 CC(=O)c1cc(ccc1O)Cl A15448 [1,0,1,0,0,0|1,0,1]=4 57 B11R1.167 Cc1ccc(c(c1)C(=O)O)O B20040 [1,0,1,0,0,0|2,0,0]=4 58 B11R1.167 Cc1ccc(cc1C(=O)O)Cl H60649 [1,0,1,0,0,0|2,0,0]=4 59 B11R1.167 c1c(cnc(c1C(=O)O)O)Cl B20706 [1,0,1,0,0,0|2,0,0]=4 60 B11R1.167 c1cc(c(cc1Br)C(=O)O)O B20338 [1,0,1,0,0,0|1,1,0]=4 61 B11R1.167 c1cc(c(cc1Cl)C(=O)N)O L17897 [1,0,1,0,0,0|0,0,2]=4 62 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Br A10103 [1,0,1,0,0,0|2,0,0]=4 63 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Cl A16108 [1,0,1,0,0,0|2,0,0]=4 64 B11R1.167 c1cc(c(cc1Cl)C(=O)O)F B23776 [1,0,1,0,0,0|2,0,0]=4 65 B11R1.167 c1cc(c(cc1Cl)C(=O)O)N A14329 [1,0,1,0,0,0|2,0,0]=4 66 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O B23984 [1,0,1,0,0,0|1,0,0]=3 67 B11R1.167 c1cc(c(cc1F)C(=O)O)O B21751 [1,0,1,0,0,0|1,1,0]=4 68 B11R1.167 c1cc(c(cc1I)C(=O)O)O B21291 [1,0,1,0,0,0|1,1,0]=4 69 B11R1.167 c1cc(c(cc1N)C(=O)O)O B23970 [1,0,1,0,0,0|2,0,0]=4 70 B11R1.167 c1cc(c(cc1O)C(=O)O)O A11459 [1,0,1,0,0,0|2,0,0]=4 71 B11R1.22 Cc1ccc(cc1)\C(=N\O)\N H51704 [1,0,1,0,0,0|2,0,0]=4 72 B11R1.22 c1cc(ccc1\C(=N\O)\N)F H66567 [1,0,1,0,0,0|1,1,0]=4 73 B11R1.22 c1cc(ccc1\C(=N\O)\N)N H51788 [1,0,1,0,0,0|2,0,0]=4 74 B11R1.22 c1cc(ccc1\C(=N\O)\N)O H52148 [1,0,1,0,0,0|2,0,0]=4 75 B11R1.23 Cc1cccc(c1)\C(=N\O)\N H50682 [1,0,1,0,0,0|2,0,0]=4 76 B11R1.23 c1cc(cc(c1)Cl)C(=O)OO L00286 [1,0,1,0,0,0|1,0,1]=4 77 B11R1.23 c1cc(cc(c1)N)\C(=N\O)\N H51773 [1,0,1,0,0,0|2,0,0]=4 78 B11R1.23 c1cc(cc(c1)O)\C(=N\O)\N H52246 [1,0,1,0,0,0|2,0,0]=4 79 B11R1.23 c1cnc(cc1\C(=N\O)\N)Cl H65100 [1,0,1,0,0,0|2,0,0]=4 80 B11R1.192 c1cc(c(cc1N=C=O)Cl)Cl A16298 [1,0,1,0,0,0|0,0,2]=4 81 B11R1.192 c1cc(c(cc1N=C=S)Cl)Cl A19236 [1,0,1,0,0,0|0,1,1]=4 82 B11R1.192 c1cc(c(cc1\C=N\O)Cl)Cl L10202 [1,0,1,0,0,0|0,0,0]=2 83 B11R1.192 c1cc(c(cc1\C=N\O)O)O L17766 [1,0,1,0,0,0|2,0,0]=4 84 B11R1.1 c1cc(ccc1OCCO)Cl A14508 [1,0,1,0,0,0|1,0,1]=4 85 B11R1.37 COc1cc(ccc1CO)Cl H27562 [1,0,1,0,0,0|1,0,1]=4 86 B11R1.37 COc1ccc(cc1C=O)Cl H31860 [1,0,1,0,0,0|1,0,1]=4 87 B11R2.36 Cc1ccc2c(c1)cn[nH]2 H31828 [2,0,0,0,0,0|2,0,0]=4 88 B11R2.36 c1cc(cc2c1cc[nH]2)Cl B23650 [2,0,0,0,0,0|2,0,0]=4 89 B11R2.36 c1cc(nc2c1occ2)Cl H33099 [2,0,0,0,0,0|2,0,0]=4 90 B11R2.36 c1cc2c(cc1Br)cn[nH]2 H54673 [2,0,0,0,0,0|1,1,0]=4 91 B11R2.36 c1cc2c(cc1Cl)OCO2 B22534 [2,0,0,0,0,0|2,0,0]=4 92 B11R2.36 c1cc2c(cc1Cl)nco2 H27083 [2,0,0,0,0,0|2,0,0]=4 93 B11R2.36 c1cc2c(cc1F)cn[nH]2 H26033 [2,0,0,0,0,0|1,1,0]=4 94 B11R2.36 c1cc2c(cc1N)cn[nH]2 L06705 [2,0,0,0,0,0|2,0,0]=4 95 B11R2.36 c1cc2c(cc[nH]2)cc1Cl A13592 [2,0,0,0,0,0|2,0,0]=4 96 B11R2.36 c1cc2c(ccs2)cc1Cl H61748 [2,0,0,0,0,0|1,1,0]=4 97 B11R2.36 c1cc2cn[nH]c2cc1Br H32623 [2,0,0,0,0,0|1,1,0]=4 98 B11R2.36 c1cc2cn[nH]c2cc1Cl H37529 [2,0,0,0,0,0|1,0,0]=3 99 B11R2.1 c1ccc2c(c1)C(=O)CO2 A10202 [2,0,0,0,0,0|1,0,1]=4 100 B11R2.1 c1ccc2c(c1)C(=O)N=N2 L05860 [2,0,0,0,0,0|1,0,1]=4 101 B11R2.1 c1ccc2c(c1)c(=O)[nH]o2 H50899 [2,0,0,0,0,0|0,0,2]=4 102 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br H37775 [2,0,0,0,0,0|2,0,0]=4 103 B11R2.1 c1ccc2c(c1)c(n[nH]2)N H33435 [2,0,0,0,0,0|2,0,0]=4 104 B11R2.1 c1ccc2c(c1)c(ns2)Cl L17791 [2,0,0,0,0,0|1,1,0]=4 105 B13R1.2398 COc1cc(c(cc1C(=O)O)Cl)N B24281 [0,1,1,0,0,0|2,0,0]=4 106 B13R1.511 c1cc(c(cc1\C=C\C(=O)O)Cl)Cl B25308 [0,1,1,0,0,0|2,0,0]=4 107 B13R2.599 c1c(c(cc2c1OCO2)Cl)CCl L05606 [1,1,0,0,0,0|2,0,0]=4 108 B13R2.162 c1cc(cc2c1ccnc2O)Br L17800 [1,0,0,0,0,1|1,1,0]=4 109 B13R2.162 c1cc2c(cc1Cl)C(=O)CCO2 A14975 [1,0,0,0,0,1|1,0,1]=4 110 B13R2.5179 c1cc2c(ccnc2cc1Cl)O L07119 [1,0,0,0,0,1|2,0,0]=4