0 B10R1.61 BrC(c1ccccc1F)Br 1P01FO1J [0,0,0,0,0,0|3,0,1]=4 1 B10R1.61 CC(=C)c1ccccc1Br 1P005H4B [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC(=C)c1ccccc1F 1P01ACS1 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.61 CC(=C)c1ccccc1I 1P01GLJL [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 CC(=C)c1ccccc1N 1P00DF51 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.61 CC(=O)c1c[nH]ccc1=O 1P00CYEH [0,0,0,0,0,0|2,0,1]=3 6 B10R1.61 CC(=O)c1ccc[nH]c1=O 1P00EG1P [0,0,0,0,0,0|2,0,1]=3 7 B10R1.61 CC(=O)c1ccccc1Br 1P00I4LL [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 CC(=O)c1ccccc1C 1P003I51 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.61 CC(=O)c1ccccc1Cl 1P0033J6 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC(=O)c1ccccc1F 1P003GQQ [0,0,0,0,0,0|2,0,0]=2 11 B10R1.61 CC(=O)c1ccccc1I 1P0033TR [0,0,0,0,0,0|2,0,0]=2 12 B10R1.61 CC(=O)c1ccccc1N 1P0033KO [0,0,0,0,0,0|2,0,0]=2 13 B10R1.61 CC(=O)c1ccccc1N 1P003GQI [0,0,0,0,0,0|2,0,0]=2 14 B10R1.61 CC(=O)c1ccccc1O 1P0033TC [0,0,0,0,0,0|1,0,0]=1 15 B10R1.61 CC(=O)c1ccccc1S 1P00BFT3 [0,0,0,0,0,0|1,1,0]=2 16 B10R1.61 CC(=O)c1cccnc1Br 1P004PFL [0,0,0,0,0,0|3,0,0]=3 17 B10R1.61 CC(=O)c1cccnc1C 1P00APS4 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.61 CC(=O)c1cccnc1Cl 1P003413 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.61 CC(=O)c1cccnc1F 1P0058LW [0,0,0,0,0,0|3,0,0]=3 20 B10R1.61 CC(=O)c1cccnc1N 1P003DA0 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.61 CC(=O)c1ccncc1Br 1P007C19 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 CC(=O)c1ccncc1C 1P00G65L [0,0,0,0,0,0|3,0,0]=3 23 B10R1.61 CC(=O)c1ccncc1Cl 1P005PZQ [0,0,0,0,0,0|3,0,0]=3 24 B10R1.61 CC(=O)c1ccncc1F 1P003L35 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.61 CC(=O)c1ccncc1N 1P0010P1 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 CC(=O)c1ccncc1N 1P008V9A [0,0,0,0,0,0|3,0,0]=3 27 B10R1.61 CC(=O)c1ccncc1O 1P00BFML [0,0,0,0,0,0|2,0,0]=2 28 B10R1.61 CC(=O)c1cnccc1C 1P00DIDY [0,0,0,0,0,0|3,0,0]=3 29 B10R1.61 CC(=O)c1cnccc1Cl 1P01JV6G [0,0,0,0,0,0|3,0,0]=3 30 B10R1.61 CC(=O)c1cnccc1N 1P019U55 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 CC(=O)c1cnccc1N 1P0280Q1 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.61 CC(=O)c1cncnc1C 1P01AGIT [0,0,0,0,0,0|4,0,0]=4 33 B10R1.61 CC(=O)c1cncnc1N 1P01KKRL [0,0,0,0,0,0|4,0,0]=4 34 B10R1.61 CC(=O)c1ncccc1Br 1P0083FB [0,0,0,0,0,0|3,0,0]=3 35 B10R1.61 CC(=O)c1ncccc1C 1P003GRM [0,0,0,0,0,0|3,0,0]=3 36 B10R1.61 CC(=O)c1ncccc1Cl 1P0073R0 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.61 CC(=O)c1ncccc1F 1P0036MY [0,0,0,0,0,0|3,0,0]=3 38 B10R1.61 CC(=O)c1ncccc1N 1P0010P6 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.61 CC(=O)c1ncccc1O 1P0010P5 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.61 CC(=O)c1nccnc1C 1P0033J9 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.61 CC(=O)c1nccnc1Cl 1P009X3P [0,0,0,0,0,0|4,0,0]=4 42 B10R1.61 CC(=O)c1ncncc1Br 1P000MPQ [0,0,0,0,0,0|4,0,0]=4 43 B10R1.61 CC(=O)c1ncncc1Cl 1P029263 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.61 CC(c1ccccc1Br)Br 1P019XVS [0,0,0,0,0,0|3,0,1]=4 45 B10R1.61 CC(c1ccccc1Br)C 1P003EJ7 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.61 CC(c1ccccc1Br)Cl 1P01DKNF [0,0,0,0,0,0|3,0,1]=4 47 B10R1.61 CC(c1ccccc1Br)N 1P000AHK [0,0,0,0,0,0|3,0,1]=4 48 B10R1.61 CC(c1ccccc1Br)N 1P0092T3 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.61 CC(c1ccccc1Br)O 1P003DA9 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.61 CC(c1ccccc1C)Br 1P01A1EI [0,0,0,0,0,0|3,0,1]=4 51 B10R1.61 CC(c1ccccc1C)N 1P003DBW [0,0,0,0,0,0|3,0,1]=4 52 B10R1.61 CC(c1ccccc1C)N 1P003DBX [0,0,0,0,0,0|3,0,1]=4 53 B10R1.61 CC(c1ccccc1C)O 1P003DBY [0,0,0,0,0,0|2,0,1]=3 54 B10R1.61 CC(c1ccccc1Cl)Br 1P019WZ5 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.61 CC(c1ccccc1Cl)Cl 1P003ENU [0,0,0,0,0,0|3,0,1]=4 56 B10R1.61 CC(c1ccccc1Cl)N 1P003DAL [0,0,0,0,0,0|3,0,1]=4 57 B10R1.61 CC(c1ccccc1Cl)N 1P004TXJ [0,0,0,0,0,0|3,0,1]=4 58 B10R1.61 CC(c1ccccc1Cl)O 1P003DAM [0,0,0,0,0,0|2,0,1]=3 59 B10R1.61 CC(c1ccccc1Cl)S 1P019Y2B [0,0,0,0,0,0|2,1,1]=4 60 B10R1.61 CC(c1ccccc1F)Br 1P00CMDW [0,0,0,0,0,0|3,0,1]=4 61 B10R1.61 CC(c1ccccc1F)C 1P0028LT [0,0,0,0,0,0|3,0,1]=4 62 B10R1.61 CC(c1ccccc1F)Cl 1P00JZKB [0,0,0,0,0,0|3,0,1]=4 63 B10R1.61 CC(c1ccccc1F)N 1P0059PI [0,0,0,0,0,0|3,0,1]=4 64 B10R1.61 CC(c1ccccc1F)O 1P003DB1 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.61 CC(c1ccccc1F)S 1P01A8HI [0,0,0,0,0,0|2,1,1]=4 66 B10R1.61 CC(c1ccccc1I)C 1P002FFC [0,0,0,0,0,0|3,0,1]=4 67 B10R1.61 CC(c1ccccc1N)C 1P003HYD [0,0,0,0,0,0|3,0,1]=4 68 B10R1.61 CC(c1ccccc1N)N 1P01A3PI [0,0,0,0,0,0|3,0,1]=4 69 B10R1.61 CC(c1ccccc1N)O 1P003D9Y [0,0,0,0,0,0|2,0,1]=3 70 B10R1.61 CC(c1ccccc1O)C 1P0047XW [0,0,0,0,0,0|2,0,1]=3 71 B10R1.61 CC(c1ccccc1O)N 1P00H1GO [0,0,0,0,0,0|2,0,1]=3 72 B10R1.61 CC(c1ccccc1O)O 1P01DL38 [0,0,0,0,0,0|1,0,1]=2 73 B10R1.61 CC(c1ccccc1S)C 1P003HYE [0,0,0,0,0,0|2,1,1]=4 74 B10R1.61 CC(c1cccnc1C)O 1P01B7I5 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.61 CC(c1cccnc1Cl)O 1P00100N [0,0,0,0,0,0|3,0,1]=4 76 B10R1.61 CC(c1cccnc1F)O 1P00GB0N [0,0,0,0,0,0|3,0,1]=4 77 B10R1.61 CC(c1ccncc1Cl)O 1P024HLR [0,0,0,0,0,0|3,0,1]=4 78 B10R1.61 CC(c1ccncc1F)O 1P00IF6M [0,0,0,0,0,0|3,0,1]=4 79 B10R1.61 CC(c1cnccc1C)O 1P009SOU [0,0,0,0,0,0|3,0,1]=4 80 B10R1.61 CC(c1cnccc1O)C 1P01DZ0R [0,0,0,0,0,0|3,0,1]=4 81 B10R1.61 CC(c1cnccc1O)N 1P028OZO [0,0,0,0,0,0|3,0,1]=4 82 B10R1.61 CC(c1ncccc1C)O 1P00IDDS [0,0,0,0,0,0|3,0,1]=4 83 B10R1.61 CC(c1ncccc1F)O 1P003DDM [0,0,0,0,0,0|3,0,1]=4 84 B10R1.61 CC(c1ncccc1O)C 1P002HLD [0,0,0,0,0,0|3,0,1]=4 85 B10R1.61 CN(c1ccccc1Br)C 1P00FB2Q [0,0,0,0,0,0|4,0,0]=4 86 B10R1.61 CN(c1ccccc1C)C 1P0035RI [0,0,0,0,0,0|4,0,0]=4 87 B10R1.61 CN(c1ccccc1F)C 1P00C7MB [0,0,0,0,0,0|4,0,0]=4 88 B10R1.61 CN(c1ccccc1I)C 1P01A1PS [0,0,0,0,0,0|4,0,0]=4 89 B10R1.61 CN(c1ccccc1N)C 1P00BGJW [0,0,0,0,0,0|4,0,0]=4 90 B10R1.61 CN(c1ccccc1O)C 1P003AK2 [0,0,0,0,0,0|3,0,0]=3 91 B10R1.61 CN(c1ccccc1O)C 1P01K0CF [0,0,0,0,0,0|3,0,0]=3 92 B10R1.61 CN(c1ncccc1O)C 1P00CH10 [0,0,0,0,0,0|4,0,0]=4 93 B10R1.61 CS(=O)c1ccccc1Br 1P00ICU5 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.61 CS(=O)c1ccccc1N 1P019WQG [0,0,0,0,0,0|3,0,0]=3 95 B10R1.61 CS(=O)c1ccccc1O 1P008565 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.61 C[C@@H](c1ccccc1Br)N 1P001D2B [0,0,0,0,0,0|3,0,1]=4 97 B10R1.61 C[C@@H](c1ccccc1Br)N 1P008ZLH [0,0,0,0,0,0|3,0,1]=4 98 B10R1.61 C[C@@H](c1ccccc1Br)O 1P000EVE [0,0,0,0,0,0|2,0,1]=3 99 B10R1.61 C[C@@H](c1ccccc1C)N 1P0014ZZ [0,0,0,0,0,0|3,0,1]=4 100 B10R1.61 C[C@@H](c1ccccc1C)N 1P00G60I [0,0,0,0,0,0|3,0,1]=4 101 B10R1.61 C[C@@H](c1ccccc1C)O 1P00DA1B [0,0,0,0,0,0|2,0,1]=3 102 B10R1.61 C[C@@H](c1ccccc1Cl)N 1P005LCN [0,0,0,0,0,0|3,0,1]=4 103 B10R1.61 C[C@@H](c1ccccc1Cl)N 1P009ZP2 [0,0,0,0,0,0|3,0,1]=4 104 B10R1.61 C[C@@H](c1ccccc1Cl)O 1P0010AH [0,0,0,0,0,0|2,0,1]=3 105 B10R1.61 C[C@@H](c1ccccc1F)N 1P001501 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.61 C[C@@H](c1ccccc1F)N 1P006CBN [0,0,0,0,0,0|3,0,1]=4 107 B10R1.61 C[C@@H](c1ccccc1F)O 1P007UPU [0,0,0,0,0,0|2,0,1]=3 108 B10R1.61 C[C@@H](c1ccccc1O)N 1P007NTC [0,0,0,0,0,0|2,0,1]=3 109 B10R1.61 C[C@@H](c1ccccc1O)N 1P024HV8 [0,0,0,0,0,0|2,0,1]=3 110 B10R1.61 C[C@@H](c1cccnc1F)O 1P0288J7 [0,0,0,0,0,0|3,0,1]=4 111 B10R1.61 C[C@@H](c1ccncc1Cl)O 1P028Z6D [0,0,0,0,0,0|3,0,1]=4 112 B10R1.61 C[C@@H](c1cnccc1Cl)O 1P024ZGG [0,0,0,0,0,0|3,0,1]=4 113 B10R1.61 C[C@@H](c1ncccc1Br)O 1P01C38K [0,0,0,0,0,0|3,0,1]=4 114 B10R1.61 C[C@@H](c1ncccc1Br)O 1P01XBYD [0,0,0,0,0,0|3,0,1]=4 115 B10R1.61 C[C@@H](c1ncccc1F)O 1P01BGYU [0,0,0,0,0,0|3,0,1]=4 116 B10R1.61 C[C@H](c1ccccc1Br)N 1P000AOU [0,0,0,0,0,0|3,0,1]=4 117 B10R1.61 C[C@H](c1ccccc1Br)N 1P0092RK [0,0,0,0,0,0|3,0,1]=4 118 B10R1.61 C[C@H](c1ccccc1Br)O 1P0058C2 [0,0,0,0,0,0|2,0,1]=3 119 B10R1.61 C[C@H](c1ccccc1C)N 1P008HMX [0,0,0,0,0,0|3,0,1]=4 120 B10R1.61 C[C@H](c1ccccc1C)N 1P008Y12 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.61 C[C@H](c1ccccc1C)O 1P00CLM3 [0,0,0,0,0,0|2,0,1]=3 122 B10R1.61 C[C@H](c1ccccc1Cl)N 1P000DMI [0,0,0,0,0,0|3,0,1]=4 123 B10R1.61 C[C@H](c1ccccc1Cl)N 1P000XTH [0,0,0,0,0,0|3,0,1]=4 124 B10R1.61 C[C@H](c1ccccc1Cl)O 1P003CNI [0,0,0,0,0,0|2,0,1]=3 125 B10R1.61 C[C@H](c1ccccc1F)N 1P000DPW [0,0,0,0,0,0|3,0,1]=4 126 B10R1.61 C[C@H](c1ccccc1F)N 1P007790 [0,0,0,0,0,0|3,0,1]=4 127 B10R1.61 C[C@H](c1ccccc1F)O 1P00HZ87 [0,0,0,0,0,0|2,0,1]=3 128 B10R1.61 C[C@H](c1ccccc1O)N 1P000LS1 [0,0,0,0,0,0|2,0,1]=3 129 B10R1.61 C[C@H](c1ccccc1O)N 1P01BTZ7 [0,0,0,0,0,0|2,0,1]=3 130 B10R1.61 C[C@H](c1ccccc1O)O 1P023PVI [0,0,0,0,0,0|1,0,1]=2 131 B10R1.61 C[C@H](c1cccnc1F)O 1P024V0A [0,0,0,0,0,0|3,0,1]=4 132 B10R1.61 C[C@H](c1ccncc1Br)O 1P01BUCK [0,0,0,0,0,0|3,0,1]=4 133 B10R1.61 C[C@H](c1ccncc1Cl)O 1P028ZSS [0,0,0,0,0,0|3,0,1]=4 134 B10R1.61 C[C@H](c1cnccc1Cl)O 1P028JWR [0,0,0,0,0,0|3,0,1]=4 135 B10R1.61 C[C@H](c1ncccc1Br)O 1P01C38Q [0,0,0,0,0,0|3,0,1]=4 136 B10R1.61 C[C@H](c1ncccc1F)O 1P01BH00 [0,0,0,0,0,0|3,0,1]=4 137 B10R1.61 ClC(=O)c1ccccc1Br 1P003H8A [0,0,0,0,0,0|2,0,0]=2 138 B10R1.61 ClC(=O)c1ccccc1C 1P003TYW [0,0,0,0,0,0|2,0,0]=2 139 B10R1.61 ClC(=O)c1ccccc1Cl 1P003HII [0,0,0,0,0,0|2,0,0]=2 140 B10R1.61 ClC(=O)c1ccccc1F 1P003HSA [0,0,0,0,0,0|2,0,0]=2 141 B10R1.61 ClC(=O)c1ccccc1I 1P003HXI [0,0,0,0,0,0|2,0,0]=2 142 B10R1.61 ClC(=O)c1cccnc1Cl 1P00I9BS [0,0,0,0,0,0|3,0,0]=3 143 B10R1.61 ClC(=O)c1cccnc1F 1P000QAE [0,0,0,0,0,0|3,0,0]=3 144 B10R1.61 ClC(=O)c1ccncc1Br 1P01C2FU [0,0,0,0,0,0|3,0,0]=3 145 B10R1.61 ClC(=O)c1cncnc1Cl 1P01DZ34 [0,0,0,0,0,0|4,0,0]=4 146 B10R1.61 ClC(c1ccccc1Cl)Cl 1P0048YG [0,0,0,0,0,0|3,0,1]=4 147 B10R1.61 ClP(c1ccccc1Br)Cl 1P028NL7 [0,0,0,0,0,0|4,0,0]=4 148 B10R1.61 ClS(=O)c1ccccc1Cl 1P01DZLM [0,0,0,0,0,0|3,0,0]=3 149 B10R1.61 ClS(=O)c1ccccc1F 1P01BRL7 [0,0,0,0,0,0|3,0,0]=3 150 B10R1.61 FC(=O)c1ccccc1F 1P01XIN5 [0,0,0,0,0,0|2,0,0]=2 151 B10R1.61 FC(c1ccccc1Br)F 1P004RGC [0,0,0,0,0,0|3,0,1]=4 152 B10R1.61 FC(c1ccccc1F)F 1P003HM5 [0,0,0,0,0,0|3,0,1]=4 153 B10R1.61 FC(c1ccccc1I)F 1P01DYZ2 [0,0,0,0,0,0|3,0,1]=4 154 B10R1.61 FC(c1ccccc1N)F 1P001IHD [0,0,0,0,0,0|3,0,1]=4 155 B10R1.61 FC(c1ccccc1N)F 1P005Q2L [0,0,0,0,0,0|3,0,1]=4 156 B10R1.61 FC(c1ccncc1O)F 1P01KL6R [0,0,0,0,0,0|3,0,1]=4 157 B10R1.61 NC(=N)c1ccccc1Br 1P00EGII [0,0,0,0,0,0|3,0,0]=3 158 B10R1.61 NC(=N)c1ccccc1C 1P003I59 [0,0,0,0,0,0|3,0,0]=3 159 B10R1.61 NC(=N)c1ccccc1Cl 1P003HI9 [0,0,0,0,0,0|3,0,0]=3 160 B10R1.61 NC(=N)c1ccccc1Cl 1P00D8UO [0,0,0,0,0,0|3,0,0]=3 161 B10R1.61 NC(=N)c1ccccc1F 1P00E9F1 [0,0,0,0,0,0|3,0,0]=3 162 B10R1.61 NC(=N)c1ccccc1F 1P00FGXY [0,0,0,0,0,0|3,0,0]=3 163 B10R1.61 NC(=N)c1ccccc1F 1P01C65V [0,0,0,0,0,0|3,0,0]=3 164 B10R1.61 NC(=N)c1ccccc1F 1P02841W [0,0,0,0,0,0|3,0,0]=3 165 B10R1.61 NC(=N)c1ccccc1O 1P00DK4F [0,0,0,0,0,0|2,0,0]=2 166 B10R1.61 NC(=N)c1ncccc1Br 1P0090E6 [0,0,0,0,0,0|4,0,0]=4 167 B10R1.61 NC(=N)c1ncccc1C 1P000PEE [0,0,0,0,0,0|4,0,0]=4 168 B10R1.61 NC(=N)c1ncccc1Cl 1P0090DX [0,0,0,0,0,0|4,0,0]=4 169 B10R1.61 NC(=O)c1ccccc1Br 1P00BXYL [0,0,0,0,0,0|2,0,0]=2 170 B10R1.61 NC(=O)c1ccccc1C 1P003I57 [0,0,0,0,0,0|2,0,0]=2 171 B10R1.61 NC(=O)c1ccccc1Cl 1P003HI8 [0,0,0,0,0,0|2,0,0]=2 172 B10R1.61 NC(=O)c1ccccc1F 1P003HS3 [0,0,0,0,0,0|2,0,0]=2 173 B10R1.61 NC(=O)c1ccccc1I 1P00C7AR [0,0,0,0,0,0|2,0,0]=2 174 B10R1.61 NC(=O)c1ccccc1N 1P003GZT [0,0,0,0,0,0|2,0,0]=2 175 B10R1.61 NC(=O)c1ccccc1O 1P003UNA [0,0,0,0,0,0|1,0,0]=1 176 B10R1.61 NC(=O)c1ccccc1S 1P01AHBV [0,0,0,0,0,0|1,1,0]=2 177 B10R1.61 NC(=O)c1cccnc1Br 1P004KW5 [0,0,0,0,0,0|3,0,0]=3 178 B10R1.61 NC(=O)c1cccnc1C 1P0036DJ [0,0,0,0,0,0|3,0,0]=3 179 B10R1.61 NC(=O)c1cccnc1Cl 1P003HJJ [0,0,0,0,0,0|3,0,0]=3 180 B10R1.61 NC(=O)c1cccnc1N 1P003H0N [0,0,0,0,0,0|3,0,0]=3 181 B10R1.61 NC(=O)c1cccnc1S 1P00E1PI [0,0,0,0,0,0|2,1,0]=3 182 B10R1.61 NC(=O)c1ccn[nH]c1=O 1P00BVJX [0,0,0,0,0,0|3,0,1]=4 183 B10R1.61 NC(=O)c1ccncc1Br 1P001BRK [0,0,0,0,0,0|3,0,0]=3 184 B10R1.61 NC(=O)c1ccncc1C 1P002QZ3 [0,0,0,0,0,0|3,0,0]=3 185 B10R1.61 NC(=O)c1ccncc1Cl 1P0003HU [0,0,0,0,0,0|3,0,0]=3 186 B10R1.61 NC(=O)c1ccncc1F 1P00ACKC [0,0,0,0,0,0|3,0,0]=3 187 B10R1.61 NC(=O)c1ccncc1N 1P003JEB [0,0,0,0,0,0|3,0,0]=3 188 B10R1.61 NC(=O)c1ccncc1N 1P00EAYC [0,0,0,0,0,0|3,0,0]=3 189 B10R1.61 NC(=O)c1ccncc1N 1P01AL91 [0,0,0,0,0,0|3,0,0]=3 190 B10R1.61 NC(=O)c1ccncc1O 1P0004LB [0,0,0,0,0,0|2,0,0]=2 191 B10R1.61 NC(=O)c1cnccc1Br 1P027UFY [0,0,0,0,0,0|3,0,0]=3 192 B10R1.61 NC(=O)c1cnccc1C 1P005T1X [0,0,0,0,0,0|3,0,0]=3 193 B10R1.61 NC(=O)c1cnccc1Cl 1P005DUV [0,0,0,0,0,0|3,0,0]=3 194 B10R1.61 NC(=O)c1cnccc1N 1P00FCTF [0,0,0,0,0,0|3,0,0]=3 195 B10R1.61 NC(=O)c1cnccc1O 1P00FFRW [0,0,0,0,0,0|2,0,0]=2 196 B10R1.61 NC(=O)c1cncnc1N 1P00DCM8 [0,0,0,0,0,0|4,0,0]=4 197 B10R1.61 NC(=O)c1cncnc1O 1P00DG2R [0,0,0,0,0,0|3,0,0]=3 198 B10R1.61 NC(=O)c1ncc[nH]c1=O 1P009CO6 [0,0,0,0,0,0|3,0,1]=4 199 B10R1.61 NC(=O)c1ncccc1Br 1P00CJQP [0,0,0,0,0,0|3,0,0]=3 200 B10R1.61 NC(=O)c1ncccc1C 1P00GT5N [0,0,0,0,0,0|3,0,0]=3 201 B10R1.61 NC(=O)c1ncccc1Cl 1P000AYW [0,0,0,0,0,0|3,0,0]=3 202 B10R1.61 NC(=O)c1ncccc1N 1P00D8IG [0,0,0,0,0,0|3,0,0]=3 203 B10R1.61 NC(=O)c1ncccc1O 1P003K1J [0,0,0,0,0,0|2,0,0]=2 204 B10R1.61 NC(=O)c1nccnc1Br 1P002VB7 [0,0,0,0,0,0|4,0,0]=4 205 B10R1.61 NC(=O)c1nccnc1Cl 1P003JS7 [0,0,0,0,0,0|4,0,0]=4 206 B10R1.61 NC(=O)c1nccnc1N 1P00CAO8 [0,0,0,0,0,0|4,0,0]=4 207 B10R1.61 NC(=O)c1nccnc1O 1P003K1L [0,0,0,0,0,0|3,0,0]=3 208 B10R1.61 NC(=S)c1ccccc1Br 1P003H9S [0,0,0,0,0,0|2,1,0]=3 209 B10R1.61 NC(=S)c1ccccc1C 1P00D8TE [0,0,0,0,0,0|2,1,0]=3 210 B10R1.61 NC(=S)c1ccccc1Cl 1P001PQE [0,0,0,0,0,0|2,1,0]=3 211 B10R1.61 NC(=S)c1ccccc1F 1P005TSU [0,0,0,0,0,0|2,1,0]=3 212 B10R1.61 NC(=S)c1ccccc1N 1P002OYJ [0,0,0,0,0,0|2,1,0]=3 213 B10R1.61 NC(=S)c1ccccc1O 1P005VU3 [0,0,0,0,0,0|1,1,0]=2 214 B10R1.61 NC(=S)c1ccccc1S 1P0286LO [0,0,0,0,0,0|1,2,0]=3 215 B10R1.61 NC(=S)c1cccnc1N 1P00COUK [0,0,0,0,0,0|3,1,0]=4 216 B10R1.61 NC(=S)c1cccnc1O 1P0290Z1 [0,0,0,0,0,0|2,1,0]=3 217 B10R1.61 NC(=S)c1ncccc1Br 1P01DTCH [0,0,0,0,0,0|3,1,0]=4 218 B10R1.61 O=N(=O)c1ccccc1C 1P003IA0 [0,0,0,0,0,0|2,0,1]=3 219 B10R1.61 O=N(=O)c1ccccc1Cl 1P00IKVH [0,0,0,0,0,0|2,0,1]=3 220 B10R1.61 O=N(=O)c1ccccc1N 1P003TY5 [0,0,0,0,0,0|2,0,1]=3 221 B10R1.61 O=N(=O)c1ccccc1O 1P003TY6 [0,0,0,0,0,0|1,0,1]=2 222 B10R1.61 O=N(=O)c1cccnc1C 1P00EAXE [0,0,0,0,0,0|3,0,1]=4 223 B10R1.61 OB(c1ccc[nH]c1=O)O 1P00IJ98 [0,0,0,0,0,0|2,0,2]=4 224 B10R1.61 OB(c1ccccc1Br)O 1P003H9F [0,0,0,0,0,0|2,0,1]=3 225 B10R1.61 OB(c1ccccc1C)O 1P001V6E [0,0,0,0,0,0|2,0,1]=3 226 B10R1.61 OB(c1ccccc1Cl)O 1P0033Q8 [0,0,0,0,0,0|2,0,1]=3 227 B10R1.61 OB(c1ccccc1F)O 1P002CIJ [0,0,0,0,0,0|2,0,1]=3 228 B10R1.61 OB(c1ccccc1I)O 1P0003EI [0,0,0,0,0,0|2,0,1]=3 229 B10R1.61 OB(c1ccccc1N)O 1P004QFZ [0,0,0,0,0,0|2,0,1]=3 230 B10R1.61 OB(c1ccccc1O)O 1P003HWL [0,0,0,0,0,0|1,0,1]=2 231 B10R1.61 OB(c1cccnc1Br)O 1P003C2V [0,0,0,0,0,0|3,0,1]=4 232 B10R1.61 OB(c1cccnc1C)O 1P0033W6 [0,0,0,0,0,0|3,0,1]=4 233 B10R1.61 OB(c1cccnc1C)O 1P00GSLX [0,0,0,0,0,0|3,0,1]=4 234 B10R1.61 OB(c1cccnc1Cl)O 1P003HCS [0,0,0,0,0,0|3,0,1]=4 235 B10R1.61 OB(c1cccnc1F)O 1P0020B7 [0,0,0,0,0,0|3,0,1]=4 236 B10R1.61 OB(c1cccnc1N)O 1P008UJI [0,0,0,0,0,0|3,0,1]=4 237 B10R1.61 OB(c1cccnc1N)O 1P0289CB [0,0,0,0,0,0|3,0,1]=4 238 B10R1.61 OB(c1ccncc1Br)O 1P003JLW [0,0,0,0,0,0|3,0,1]=4 239 B10R1.61 OB(c1ccncc1C)O 1P003489 [0,0,0,0,0,0|3,0,1]=4 240 B10R1.61 OB(c1ccncc1C)O 1P003C9J [0,0,0,0,0,0|3,0,1]=4 241 B10R1.61 OB(c1ccncc1Cl)O 1P00D8GH [0,0,0,0,0,0|3,0,1]=4 242 B10R1.61 OB(c1ccncc1F)O 1P003JYG [0,0,0,0,0,0|3,0,1]=4 243 B10R1.61 OB(c1cnccc1C)O 1P001LGF [0,0,0,0,0,0|3,0,1]=4 244 B10R1.61 OB(c1cnccc1Cl)O 1P00DAVF [0,0,0,0,0,0|3,0,1]=4 245 B10R1.61 OB(c1cnccc1N)O 1P00IK6A [0,0,0,0,0,0|3,0,1]=4 246 B10R1.61 OB(c1ncccc1C)O 1P003487 [0,0,0,0,0,0|3,0,1]=4 247 B10R1.61 OB(c1ncccc1Cl)O 1P01B29V [0,0,0,0,0,0|3,0,1]=4 248 B10R1.61 OB(c1ncccc1F)O 1P007TWO [0,0,0,0,0,0|3,0,1]=4 249 B10R1.61 OC(=O)C1C=CC=NC1=O 1P01KLDR [0,0,0,0,0,0|1,0,2]=3 250 B10R1.61 OC(=O)c1cccc[n+]1[O-] 1P003U8Q [0,0,0,0,0,0|1,0,1]=2 251 B10R1.61 OC(=O)c1ccccc1Br 1P0033MS [0,0,0,0,0,0|1,0,0]=1 252 B10R1.61 OC(=O)c1ccccc1C 1P0035WF [0,0,0,0,0,0|1,0,0]=1 253 B10R1.61 OC(=O)c1ccccc1Cl 1P003HIE [0,0,0,0,0,0|1,0,0]=1 254 B10R1.61 OC(=O)c1ccccc1F 1P003HS6 [0,0,0,0,0,0|1,0,0]=1 255 B10R1.61 OC(=O)c1ccccc1I 1P00IFBA [0,0,0,0,0,0|1,0,0]=1 256 B10R1.61 OC(=O)c1ccccc1O 1P0072Q7 [0,0,0,0,0,0|0,0,0]=0 257 B10R1.61 OC(=O)c1ccccc1O 1P00GA1V [0,0,0,0,0,0|0,0,0]=0 258 B10R1.61 OC(=O)c1cccnc1Br 1P007DQN [0,0,0,0,0,0|2,0,0]=2 259 B10R1.61 OC(=O)c1cccnc1C 1P003I6J [0,0,0,0,0,0|2,0,0]=2 260 B10R1.61 OC(=O)c1cccnc1C 1P007Q5X [0,0,0,0,0,0|2,0,0]=2 261 B10R1.61 OC(=O)c1cccnc1Cl 1P002YTC [0,0,0,0,0,0|2,0,0]=2 262 B10R1.61 OC(=O)c1cccnc1F 1P003HSN [0,0,0,0,0,0|2,0,0]=2 263 B10R1.61 OC(=O)c1cccnc1I 1P00EGNX [0,0,0,0,0,0|2,0,0]=2 264 B10R1.61 OC(=O)c1cccnc1N 1P0033L3 [0,0,0,0,0,0|2,0,0]=2 265 B10R1.61 OC(=O)c1cccnc1O 1P0033TM [0,0,0,0,0,0|1,0,0]=1 266 B10R1.61 OC(=O)c1cccnc1S 1P003HZ1 [0,0,0,0,0,0|1,1,0]=2 267 B10R1.61 OC(=O)c1ccn[nH]c1=O 1P00348K [0,0,0,0,0,0|2,0,1]=3 268 B10R1.61 OC(=O)c1ccncc1Br 1P001BSI [0,0,0,0,0,0|2,0,0]=2 269 B10R1.61 OC(=O)c1ccncc1C 1P0039KX [0,0,0,0,0,0|2,0,0]=2 270 B10R1.61 OC(=O)c1ccncc1C 1P00ELDZ [0,0,0,0,0,0|2,0,0]=2 271 B10R1.61 OC(=O)c1ccncc1Cl 1P008AMD [0,0,0,0,0,0|2,0,0]=2 272 B10R1.61 OC(=O)c1ccncc1F 1P003JYI [0,0,0,0,0,0|2,0,0]=2 273 B10R1.61 OC(=O)c1ccncc1I 1P00E99I [0,0,0,0,0,0|2,0,0]=2 274 B10R1.61 OC(=O)c1ccncc1N 1P003JEC [0,0,0,0,0,0|2,0,0]=2 275 B10R1.61 OC(=O)c1ccncc1O 1P0004LD [0,0,0,0,0,0|1,0,0]=1 276 B10R1.61 OC(=O)c1ccncc1S 1P002331 [0,0,0,0,0,0|1,1,0]=2 277 B10R1.61 OC(=O)c1ccnnc1C 1P00II15 [0,0,0,0,0,0|3,0,0]=3 278 B10R1.61 OC(=O)c1ccnnc1Cl 1P0007O6 [0,0,0,0,0,0|3,0,0]=3 279 B10R1.61 OC(=O)c1ccnnc1N 1P002LSA [0,0,0,0,0,0|3,0,0]=3 280 B10R1.61 OC(=O)c1ccnnc1S 1P01C250 [0,0,0,0,0,0|2,1,0]=3 281 B10R1.61 OC(=O)c1cnc[nH]c1=O 1P00FCM6 [0,0,0,0,0,0|2,0,1]=3 282 B10R1.61 OC(=O)c1cnccc1Br 1P003875 [0,0,0,0,0,0|2,0,0]=2 283 B10R1.61 OC(=O)c1cnccc1C 1P003M9A [0,0,0,0,0,0|2,0,0]=2 284 B10R1.61 OC(=O)c1cnccc1C 1P00GSON [0,0,0,0,0,0|2,0,0]=2 285 B10R1.61 OC(=O)c1cnccc1Cl 1P0005WO [0,0,0,0,0,0|2,0,0]=2 286 B10R1.61 OC(=O)c1cnccc1F 1P007K8H [0,0,0,0,0,0|2,0,0]=2 287 B10R1.61 OC(=O)c1cnccc1I 1P01FJ5J [0,0,0,0,0,0|2,0,0]=2 288 B10R1.61 OC(=O)c1cnccc1N 1P003L8E [0,0,0,0,0,0|2,0,0]=2 289 B10R1.61 OC(=O)c1cnccc1O 1P003M09 [0,0,0,0,0,0|1,0,0]=1 290 B10R1.61 OC(=O)c1cnccc1S 1P002333 [0,0,0,0,0,0|1,1,0]=2 291 B10R1.61 OC(=O)c1cncnc1C 1P001PV1 [0,0,0,0,0,0|3,0,0]=3 292 B10R1.61 OC(=O)c1cncnc1Cl 1P00GVDA [0,0,0,0,0,0|3,0,0]=3 293 B10R1.61 OC(=O)c1cncnc1N 1P002JH7 [0,0,0,0,0,0|3,0,0]=3 294 B10R1.61 OC(=O)c1cnncc1C 1P0095BV [0,0,0,0,0,0|3,0,0]=3 295 B10R1.61 OC(=O)c1cnncc1C 1P028E7P [0,0,0,0,0,0|3,0,0]=3 296 B10R1.61 OC(=O)c1cnncc1N 1P00712X [0,0,0,0,0,0|3,0,0]=3 297 B10R1.61 OC(=O)c1cnncc1O 1P01AUXL [0,0,0,0,0,0|2,0,0]=2 298 B10R1.61 OC(=O)c1n[nH]ccc1=O 1P01A4WY [0,0,0,0,0,0|2,0,1]=3 299 B10R1.61 OC(=O)c1ncc[nH]c1=O 1P002JH6 [0,0,0,0,0,0|2,0,1]=3 300 B10R1.61 OC(=O)c1ncccc1Br 1P00319D [0,0,0,0,0,0|2,0,0]=2 301 B10R1.61 OC(=O)c1ncccc1C 1P000LL7 [0,0,0,0,0,0|2,0,0]=2 302 B10R1.61 OC(=O)c1ncccc1C 1P003488 [0,0,0,0,0,0|2,0,0]=2 303 B10R1.61 OC(=O)c1ncccc1Cl 1P003JRZ [0,0,0,0,0,0|2,0,0]=2 304 B10R1.61 OC(=O)c1ncccc1F 1P006UT0 [0,0,0,0,0,0|2,0,0]=2 305 B10R1.61 OC(=O)c1ncccc1I 1P005WO7 [0,0,0,0,0,0|2,0,0]=2 306 B10R1.61 OC(=O)c1ncccc1N 1P001E9I [0,0,0,0,0,0|2,0,0]=2 307 B10R1.61 OC(=O)c1ncccc1O 1P00DBOF [0,0,0,0,0,0|1,0,0]=1 308 B10R1.61 OC(=O)c1ncccc1S 1P00C9IZ [0,0,0,0,0,0|1,1,0]=2 309 B10R1.61 OC(=O)c1nccnc1Br 1P00H1EL [0,0,0,0,0,0|3,0,0]=3 310 B10R1.61 OC(=O)c1nccnc1C 1P003485 [0,0,0,0,0,0|3,0,0]=3 311 B10R1.61 OC(=O)c1nccnc1Cl 1P003JS8 [0,0,0,0,0,0|3,0,0]=3 312 B10R1.61 OC(=O)c1nccnc1F 1P01OMF7 [0,0,0,0,0,0|3,0,0]=3 313 B10R1.61 OC(=O)c1nccnc1I 1P007P3R [0,0,0,0,0,0|3,0,0]=3 314 B10R1.61 OC(=O)c1nccnc1N 1P003JEP [0,0,0,0,0,0|3,0,0]=3 315 B10R1.61 OC(=O)c1nccnc1S 1P01ANEF [0,0,0,0,0,0|2,1,0]=3 316 B10R1.61 OC(=O)c1ncncc1Br 1P0037F5 [0,0,0,0,0,0|3,0,0]=3 317 B10R1.61 OC(=O)c1ncncc1C 1P00II0M [0,0,0,0,0,0|3,0,0]=3 318 B10R1.61 OC(=O)c1ncncc1Cl 1P00EKD0 [0,0,0,0,0,0|3,0,0]=3 319 B10R1.61 OC(=O)c1ncncc1F 1P0092A9 [0,0,0,0,0,0|3,0,0]=3 320 B10R1.61 OC(=O)c1ncncc1N 1P00EB8C [0,0,0,0,0,0|3,0,0]=3 321 B10R1.61 OC(=O)c1ncnnc1N 1P00CB8M [0,0,0,0,0,0|4,0,0]=4 322 B10R1.61 OC(=O)c1nnccc1C 1P00BGLQ [0,0,0,0,0,0|3,0,0]=3 323 B10R1.61 OC(=O)c1nnccc1C 1P028XRQ [0,0,0,0,0,0|3,0,0]=3 324 B10R1.61 OC(=S)c1ccccc1O 1P006V4J [0,0,0,0,0,0|0,1,0]=1 325 B10R1.61 [O-]C(=O)c1ccccc1Cl 1P00APO5 [0,0,0,0,0,0|1,0,1]=2 326 B10R1.61 [O-]C(=O)c1ccccc1F 1P006WEJ [0,0,0,0,0,0|1,0,1]=2 327 B10R1.61 [O-]C(=O)c1ccccc1O 1P002IGB [0,0,0,0,0,0|0,0,1]=1 328 B10R1.61 [O-]C(=O)c1ccccc1O 1P00352J [0,0,0,0,0,0|0,0,1]=1 329 B10R1.61 [O-]C(=O)c1ccccc1O 1P003OC6 [0,0,0,0,0,0|0,0,1]=1 330 B10R1.61 [O-]C(=O)c1ccccc1O 1P003RSL [0,0,0,0,0,0|0,0,1]=1 331 B10R1.61 [O-]C(=O)c1ccccc1O 1P003UUP [0,0,0,0,0,0|0,0,1]=1 332 B10R1.61 [O-]C(=O)c1ccccc1O 1P00IAR4 [0,0,0,0,0,0|0,0,1]=1 333 B10R1.61 [O-]C(=O)c1ccccc1S 1P003V9F [0,0,0,0,0,0|0,1,1]=2 334 B10R1.61 [O-]C(=O)c1ncccc1Br 1P008VJH [0,0,0,0,0,0|2,0,1]=3 335 B10R1.61 [O-]C(=O)c1ncccc1O 1P00IEYX [0,0,0,0,0,0|1,0,1]=2 336 B10R1.61 [O-]C(=O)c1ncncc1F 1P028CCT [0,0,0,0,0,0|3,0,1]=4 337 B10R1.61 [O-]S(=O)c1ccccc1Br 1P01C8NU [0,0,0,0,0,0|2,0,1]=3 338 B10R1.61 [O-]S(=O)c1ccccc1C 1P00B5ML [0,0,0,0,0,0|2,0,1]=3 339 B10R1.61 [O-]S(=O)c1ccccc1C 1P028LVY [0,0,0,0,0,0|2,0,1]=3 340 B10R1.61 [O-]S(=O)c1ccccc1Cl 1P001RKU [0,0,0,0,0,0|2,0,1]=3 341 B10R1.61 [O-]S(=O)c1ccccc1F 1P01BEXE [0,0,0,0,0,0|2,0,1]=3 342 B10R1.61 [O-]S(=O)c1cccnc1Cl 1P01FJ1V [0,0,0,0,0,0|3,0,1]=4 343 B10R1.61 [O-]S(=O)c1cccnc1F 1P01FLAH [0,0,0,0,0,0|3,0,1]=4 344 B10R1.61 [O-]S(=O)c1ccncc1C 1P028JRO [0,0,0,0,0,0|3,0,1]=4 345 B10R1.61 [O-]S(=O)c1ncccc1C 1P01KLCL [0,0,0,0,0,0|3,0,1]=4 346 B10R1.61 [O-]S(=O)c1ncccc1C 1P0286T8 [0,0,0,0,0,0|3,0,1]=4 347 B10R1.61 [O-]S(=O)c1ncccc1Cl 1P01FLAW [0,0,0,0,0,0|3,0,1]=4 348 B10R1.61 [O-][N+](=O)c1c[nH]ccc1=O 1P001OT5 [0,0,0,0,0,0|2,0,2]=4 349 B10R1.61 [O-][N+](=O)c1cccc[n+]1[O-] 1P028ZJE [0,0,0,0,0,0|2,0,2]=4 350 B10R1.61 [O-][N+](=O)c1ccccc1Br 1P00380N [0,0,0,0,0,0|2,0,1]=3 351 B10R1.61 [O-][N+](=O)c1ccccc1F 1P001M0Y [0,0,0,0,0,0|2,0,1]=3 352 B10R1.61 [O-][N+](=O)c1ccccc1N 1P001RAI [0,0,0,0,0,0|2,0,1]=3 353 B10R1.61 [O-][N+](=O)c1ccccc1S 1P003A8J [0,0,0,0,0,0|1,1,1]=3 354 B10R1.61 [O-][N+](=O)c1ccccc1[O-] 1P003BQ2 [0,0,0,0,0,0|1,0,2]=3 355 B10R1.61 [O-][N+](=O)c1cccnc1Br 1P002BCG [0,0,0,0,0,0|3,0,1]=4 356 B10R1.61 [O-][N+](=O)c1cccnc1C 1P003I3F [0,0,0,0,0,0|3,0,1]=4 357 B10R1.61 [O-][N+](=O)c1cccnc1Cl 1P003HCQ [0,0,0,0,0,0|3,0,1]=4 358 B10R1.61 [O-][N+](=O)c1cccnc1F 1P003HPM [0,0,0,0,0,0|3,0,1]=4 359 B10R1.61 [O-][N+](=O)c1cccnc1I 1P002KMS [0,0,0,0,0,0|3,0,1]=4 360 B10R1.61 [O-][N+](=O)c1cccnc1N 1P00I8N4 [0,0,0,0,0,0|3,0,1]=4 361 B10R1.61 [O-][N+](=O)c1cccnc1O 1P0036FP [0,0,0,0,0,0|2,0,1]=3 362 B10R1.61 [O-][N+](=O)c1cccnc1S 1P003KAL [0,0,0,0,0,0|2,1,1]=4 363 B10R1.61 [O-][N+](=O)c1ccncc1Br 1P003430 [0,0,0,0,0,0|3,0,1]=4 364 B10R1.61 [O-][N+](=O)c1ccncc1C 1P001Y35 [0,0,0,0,0,0|3,0,1]=4 365 B10R1.61 [O-][N+](=O)c1ccncc1Cl 1P0010F6 [0,0,0,0,0,0|3,0,1]=4 366 B10R1.61 [O-][N+](=O)c1ccncc1F 1P008076 [0,0,0,0,0,0|3,0,1]=4 367 B10R1.61 [O-][N+](=O)c1ccncc1I 1P003K22 [0,0,0,0,0,0|3,0,1]=4 368 B10R1.61 [O-][N+](=O)c1ccncc1N 1P007M0M [0,0,0,0,0,0|3,0,1]=4 369 B10R1.61 [O-][N+](=O)c1ccncc1O 1P009DDJ [0,0,0,0,0,0|2,0,1]=3 370 B10R1.61 [O-][N+](=O)c1cnccc1Br 1P002MIG [0,0,0,0,0,0|3,0,1]=4 371 B10R1.61 [O-][N+](=O)c1cnccc1C 1P004QMA [0,0,0,0,0,0|3,0,1]=4 372 B10R1.61 [O-][N+](=O)c1cnccc1C 1P00E9CE [0,0,0,0,0,0|3,0,1]=4 373 B10R1.61 [O-][N+](=O)c1cnccc1Cl 1P000VKE [0,0,0,0,0,0|3,0,1]=4 374 B10R1.61 [O-][N+](=O)c1cnccc1F 1P000HCN [0,0,0,0,0,0|3,0,1]=4 375 B10R1.61 [O-][N+](=O)c1cnccc1N 1P001Y9X [0,0,0,0,0,0|3,0,1]=4 376 B10R1.61 [O-][N+](=O)c1cnccc1O 1P00DEG3 [0,0,0,0,0,0|2,0,1]=3 377 B10R1.61 [O-][N+](=O)c1cncnc1O 1P007P7T [0,0,0,0,0,0|3,0,1]=4 378 B10R1.61 [O-][N+](=O)c1ncccc1Br 1P003JHG [0,0,0,0,0,0|3,0,1]=4 379 B10R1.61 [O-][N+](=O)c1ncccc1C 1P00I1W2 [0,0,0,0,0,0|3,0,1]=4 380 B10R1.61 [O-][N+](=O)c1ncccc1Cl 1P003JO2 [0,0,0,0,0,0|3,0,1]=4 381 B10R1.61 [O-][N+](=O)c1ncccc1F 1P00345R [0,0,0,0,0,0|3,0,1]=4 382 B10R1.61 [O-][N+](=O)c1ncccc1I 1P00DC7R [0,0,0,0,0,0|3,0,1]=4 383 B10R1.61 [O-][N+](=O)c1ncccc1N 1P0011H7 [0,0,0,0,0,0|3,0,1]=4 384 B10R1.61 [O-][N+](=O)c1ncccc1O 1P001NOV [0,0,0,0,0,0|2,0,1]=3 385 B9R1.6 BrC(=C)c1ccccc1 1P003AO1 [1,0,0,0,0,0|2,0,0]=3 386 B9R1.6 BrC(=O)c1ccccc1 1P003OJM [1,0,0,0,0,0|1,0,0]=2 387 B9R1.6 C(=O)([2H])c1ccccc1 1P00CKBV [1,0,0,0,0,0|1,0,0]=2 388 B9R1.6 CC(=C)c1ccccn1 1P00ELW9 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.6 CC(=C)c1cccnc1 1P00B5O7 [1,0,0,0,0,0|3,0,0]=4 390 B9R1.6 CC(=O)c1ccccc1 1P0036AX [1,0,0,0,0,0|1,0,0]=2 391 B9R1.6 CC(=O)c1ccccn1 1P003GS6 [1,0,0,0,0,0|2,0,0]=3 392 B9R1.6 CC(=O)c1cccnc1 1P003JA6 [1,0,0,0,0,0|2,0,0]=3 393 B9R1.6 CC(=O)c1cccnn1 1P007UEX [1,0,0,0,0,0|3,0,0]=4 394 B9R1.6 CC(=O)c1ccncc1 1P003L3Q [1,0,0,0,0,0|2,0,0]=3 395 B9R1.6 CC(=O)c1ccncn1 1P00BYH9 [1,0,0,0,0,0|3,0,0]=4 396 B9R1.6 CC(=O)c1ccnnc1 1P006VU7 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.6 CC(=O)c1cnccn1 1P003O4N [1,0,0,0,0,0|3,0,0]=4 398 B9R1.6 CC(=O)c1cncnc1 1P003DIC [1,0,0,0,0,0|3,0,0]=4 399 B9R1.6 CC(=O)c1ncccn1 1P003GS7 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.6 CC(c1ccccc1)Br 1P003BVV [1,0,0,0,0,0|2,0,1]=4 401 B9R1.6 CC(c1ccccc1)C 1P0032S0 [1,0,0,0,0,0|2,0,1]=4 402 B9R1.6 CC(c1ccccc1)Cl 1P003ENS [1,0,0,0,0,0|2,0,1]=4 403 B9R1.6 CC(c1ccccc1)N 1P00369W [1,0,0,0,0,0|2,0,1]=4 404 B9R1.6 CC(c1ccccc1)N 1P009X79 [1,0,0,0,0,0|2,0,1]=4 405 B9R1.6 CC(c1ccccc1)S 1P003COW [1,0,0,0,0,0|1,1,1]=4 406 B9R1.6 CC(c1ccccn1)O 1P003F63 [1,0,0,0,0,0|2,0,1]=4 407 B9R1.6 CC(c1cccnc1)O 1P003IG7 [1,0,0,0,0,0|2,0,1]=4 408 B9R1.6 CC(c1ccncc1)O 1P002NIX [1,0,0,0,0,0|2,0,1]=4 409 B9R1.6 CN(c1ccccc1)C 1P003T1K [1,0,0,0,0,0|3,0,0]=4 410 B9R1.6 CN(c1ccccc1)N 1P003EY0 [1,0,0,0,0,0|3,0,0]=4 411 B9R1.6 CN(c1ccccc1)N 1P00EKZW [1,0,0,0,0,0|3,0,0]=4 412 B9R1.6 CP(c1ccccc1)C 1P003Q45 [1,0,0,0,0,0|3,0,0]=4 413 B9R1.6 CP(c1ccccc1)C 1P00BHDQ [1,0,0,0,0,0|3,0,0]=4 414 B9R1.6 CS(=O)c1ccccc1 1P000J0D [1,0,0,0,0,0|2,0,0]=3 415 B9R1.6 CS(=O)c1ccccn1 1P006YWW [1,0,0,0,0,0|3,0,0]=4 416 B9R1.6 C[C@@H](c1ccccc1)N 1P0032WG [1,0,0,0,0,0|2,0,1]=4 417 B9R1.6 C[C@@H](c1ccccc1)O 1P00HXJL [1,0,0,0,0,0|1,0,1]=3 418 B9R1.6 C[C@@H](c1ccccc1)S 1P01BVUY [1,0,0,0,0,0|1,1,1]=4 419 B9R1.6 C[C@@H](c1ccccn1)O 1P003CZH [1,0,0,0,0,0|2,0,1]=4 420 B9R1.6 C[C@@H](c1cccnc1)O 1P003CZF [1,0,0,0,0,0|2,0,1]=4 421 B9R1.6 C[C@@H](c1ccncc1)O 1P003CZI [1,0,0,0,0,0|2,0,1]=4 422 B9R1.6 C[C@H](c1ccccc1)N 1P0032UU [1,0,0,0,0,0|2,0,1]=4 423 B9R1.6 C[C@H](c1ccccc1)N 1P00BC58 [1,0,0,0,0,0|2,0,1]=4 424 B9R1.6 C[C@H](c1ccccc1)O 1P0032UN [1,0,0,0,0,0|1,0,1]=3 425 B9R1.6 C[C@H](c1ccccc1)S 1P01DWTD [1,0,0,0,0,0|1,1,1]=4 426 B9R1.6 C[C@H](c1ccccn1)O 1P0032W5 [1,0,0,0,0,0|2,0,1]=4 427 B9R1.6 C[C@H](c1cccnc1)O 1P003CNM [1,0,0,0,0,0|2,0,1]=4 428 B9R1.6 C[C@H](c1ccncc1)O 1P002VEW [1,0,0,0,0,0|2,0,1]=4 429 B9R1.6 C[Si](c1ccccc1)C 1P00358B [1,0,0,0,0,0|2,1,0]=4 430 B9R1.6 ClB(c1ccccc1)Cl 1P004HX5 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.6 ClC(=O)c1ccccc1 1P00374M [1,0,0,0,0,0|1,0,0]=2 432 B9R1.6 ClC(=O)c1ccccn1 1P002ZQS [1,0,0,0,0,0|2,0,0]=3 433 B9R1.6 ClC(=O)c1ccccn1 1P003UJ3 [1,0,0,0,0,0|2,0,0]=3 434 B9R1.6 ClC(=O)c1cccnc1 1P0028T1 [1,0,0,0,0,0|2,0,0]=3 435 B9R1.6 ClC(=O)c1cccnc1 1P008RIG [1,0,0,0,0,0|2,0,0]=3 436 B9R1.6 ClC(=O)c1ccncc1 1P003RKP [1,0,0,0,0,0|2,0,0]=3 437 B9R1.6 ClC(=O)c1cnccn1 1P002C00 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.6 ClC(=O)c1cncnc1 1P00CJ9M [1,0,0,0,0,0|3,0,0]=4 439 B9R1.6 ClC(=O)c1ncccn1 1P00CGQU [1,0,0,0,0,0|3,0,0]=4 440 B9R1.6 ClC(=S)c1ccccc1 1P01E7HC [1,0,0,0,0,0|1,1,0]=3 441 B9R1.6 ClC(c1ccccc1)Cl 1P00IKXY [1,0,0,0,0,0|2,0,1]=4 442 B9R1.6 ClP(c1ccccc1)Cl 1P0035XX [1,0,0,0,0,0|3,0,0]=4 443 B9R1.6 ClS(=O)c1ccccc1 1P00DHD9 [1,0,0,0,0,0|2,0,0]=3 444 B9R1.6 Cl[I](c1ccccc1)Cl 1P0037A2 [1,0,0,0,0,0|3,0,0]=4 445 B9R1.6 FC(=C)c1ccccc1 1P005W4Z [1,0,0,0,0,0|2,0,0]=3 446 B9R1.6 FC(=O)c1ccccc1 1P00D8I4 [1,0,0,0,0,0|1,0,0]=2 447 B9R1.6 FC(c1ccccc1)Br 1P020M24 [1,0,0,0,0,0|2,0,1]=4 448 B9R1.6 FC(c1ccccc1)F 1P00DCHS [1,0,0,0,0,0|2,0,1]=4 449 B9R1.6 NC(=N)c1ccccc1 1P002J4G [1,0,0,0,0,0|2,0,0]=3 450 B9R1.6 NC(=N)c1ccccc1 1P0034Y8 [1,0,0,0,0,0|2,0,0]=3 451 B9R1.6 NC(=N)c1ccccc1 1P003OH8 [1,0,0,0,0,0|2,0,0]=3 452 B9R1.6 NC(=N)c1ccccc1 1P00FJIS [1,0,0,0,0,0|2,0,0]=3 453 B9R1.6 NC(=N)c1ccccn1 1P0035Y9 [1,0,0,0,0,0|3,0,0]=4 454 B9R1.6 NC(=N)c1cccnc1 1P002N4J [1,0,0,0,0,0|3,0,0]=4 455 B9R1.6 NC(=N)c1cccnc1 1P003KCV [1,0,0,0,0,0|3,0,0]=4 456 B9R1.6 NC(=N)c1cccnc1 1P00EEAY [1,0,0,0,0,0|3,0,0]=4 457 B9R1.6 NC(=N)c1ccncc1 1P0035IL [1,0,0,0,0,0|3,0,0]=4 458 B9R1.6 NC(=N)c1ccncc1 1P00EDM3 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.6 NC(=O)c1ccccc1 1P00DOQ9 [1,0,0,0,0,0|1,0,0]=2 460 B9R1.6 NC(=O)c1ccccn1 1P003U8O [1,0,0,0,0,0|2,0,0]=3 461 B9R1.6 NC(=O)c1cccnc1 1P00IKH0 [1,0,0,0,0,0|2,0,0]=3 462 B9R1.6 NC(=O)c1cccnn1 1P00DL9W [1,0,0,0,0,0|3,0,0]=4 463 B9R1.6 NC(=O)c1ccncc1 1P001L8G [1,0,0,0,0,0|2,0,0]=3 464 B9R1.6 NC(=O)c1ccncn1 1P002WFX [1,0,0,0,0,0|3,0,0]=4 465 B9R1.6 NC(=O)c1ccnnc1 1P00H1KR [1,0,0,0,0,0|3,0,0]=4 466 B9R1.6 NC(=O)c1cnccn1 1P003UIG [1,0,0,0,0,0|3,0,0]=4 467 B9R1.6 NC(=O)c1cncnc1 1P00BXU6 [1,0,0,0,0,0|3,0,0]=4 468 B9R1.6 NC(=O)c1ncccn1 1P00490W [1,0,0,0,0,0|3,0,0]=4 469 B9R1.6 NC(=S)c1ccccc1 1P00365I [1,0,0,0,0,0|1,1,0]=3 470 B9R1.6 NC(=S)c1ccccn1 1P00IA0A [1,0,0,0,0,0|2,1,0]=4 471 B9R1.6 NC(=S)c1cccnc1 1P00I915 [1,0,0,0,0,0|2,1,0]=4 472 B9R1.6 NC(=S)c1ccncc1 1P003V92 [1,0,0,0,0,0|2,1,0]=4 473 B9R1.6 NS(=O)c1ccccc1 1P001SKC [1,0,0,0,0,0|2,0,0]=3 474 B9R1.6 O=N(=O)c1ccccc1 1P003TLR [1,0,0,0,0,0|1,0,1]=3 475 B9R1.6 OB(c1ccccc1)O 1P0035XS [1,0,0,0,0,0|1,0,1]=3 476 B9R1.6 OB(c1ccccn1)O 1P002BN5 [1,0,0,0,0,0|2,0,1]=4 477 B9R1.6 OB(c1cccnc1)O 1P001Z1A [1,0,0,0,0,0|2,0,1]=4 478 B9R1.6 OB(c1cccnc1)O 1P002U6U [1,0,0,0,0,0|2,0,1]=4 479 B9R1.6 OB(c1ccncc1)O 1P001Z1D [1,0,0,0,0,0|2,0,1]=4 480 B9R1.6 OB(c1ccncc1)O 1P006O18 [1,0,0,0,0,0|2,0,1]=4 481 B9R1.6 OC(=O)c1ccccc1 1P0034YN [1,0,0,0,0,0|0,0,0]=1 482 B9R1.6 OC(=O)c1ccccc1 1P003U1P [1,0,0,0,0,0|0,0,0]=1 483 B9R1.6 OC(=O)c1ccccc1 1P0080KJ [1,0,0,0,0,0|0,0,0]=1 484 B9R1.6 OC(=O)c1ccccc1 1P00GSC1 [1,0,0,0,0,0|0,0,0]=1 485 B9R1.6 OC(=O)c1ccccc1 1P01JV1A [1,0,0,0,0,0|0,0,0]=1 486 B9R1.6 OC(=O)c1ccccn1 1P0035Y8 [1,0,0,0,0,0|1,0,0]=2 487 B9R1.6 OC(=O)c1ccccn1 1P003U8P [1,0,0,0,0,0|1,0,0]=2 488 B9R1.6 OC(=O)c1cccnc1 1P00EZXS [1,0,0,0,0,0|1,0,0]=2 489 B9R1.6 OC(=O)c1cccnc1 1P00IBTV [1,0,0,0,0,0|1,0,0]=2 490 B9R1.6 OC(=O)c1cccnn1 1P00BCBL [1,0,0,0,0,0|2,0,0]=3 491 B9R1.6 OC(=O)c1cccnn1 1P01Z9RM [1,0,0,0,0,0|2,0,0]=3 492 B9R1.6 OC(=O)c1ccncc1 1P0035IK [1,0,0,0,0,0|1,0,0]=2 493 B9R1.6 OC(=O)c1ccncn1 1P003UJM [1,0,0,0,0,0|2,0,0]=3 494 B9R1.6 OC(=O)c1ccnnc1 1P0034LS [1,0,0,0,0,0|2,0,0]=3 495 B9R1.6 OC(=O)c1cnccn1 1P0033WC [1,0,0,0,0,0|2,0,0]=3 496 B9R1.6 OC(=O)c1cncnc1 1P003NF7 [1,0,0,0,0,0|2,0,0]=3 497 B9R1.6 OC(=O)c1ncccn1 1P003UJL [1,0,0,0,0,0|2,0,0]=3 498 B9R1.6 OC(=O)c1ncccn1 1P01AJVA [1,0,0,0,0,0|2,0,0]=3 499 B9R1.6 OC(=O)c1nccnn1 1P01DXUR [1,0,0,0,0,0|3,0,0]=4 500 B9R1.6 OC(=S)c1ccccc1 1P00365J [1,0,0,0,0,0|0,1,0]=2 501 B9R1.6 OP(=O)c1ccccc1 1P00262L [1,0,0,0,0,0|1,0,0]=2 502 B9R1.6 OS(=O)c1ccccc1 1P00IBDR [1,0,0,0,0,0|1,0,0]=2 503 B9R1.6 O[Se](=O)c1ccccc1 1P003OHL [1,0,0,0,0,0|1,0,0]=2 504 B9R1.6 [O-]C(=O)c1ccccc1 1P001YXL [1,0,0,0,0,0|0,0,1]=2 505 B9R1.6 [O-]C(=O)c1ccccc1 1P00361Z [1,0,0,0,0,0|0,0,1]=2 506 B9R1.6 [O-]C(=O)c1ccccc1 1P003OB0 [1,0,0,0,0,0|0,0,1]=2 507 B9R1.6 [O-]C(=O)c1ccccc1 1P003RRN [1,0,0,0,0,0|0,0,1]=2 508 B9R1.6 [O-]C(=O)c1ccccc1 1P003UCI [1,0,0,0,0,0|0,0,1]=2 509 B9R1.6 [O-]C(=O)c1ccccc1 1P003UPU [1,0,0,0,0,0|0,0,1]=2 510 B9R1.6 [O-]C(=O)c1ccccc1 1P00C9FZ [1,0,0,0,0,0|0,0,1]=2 511 B9R1.6 [O-]C(=O)c1ccccc1 1P00D9FZ [1,0,0,0,0,0|0,0,1]=2 512 B9R1.6 [O-]C(=O)c1ccccc1 1P01DORW [1,0,0,0,0,0|0,0,1]=2 513 B9R1.6 [O-]C(=O)c1ccccn1 1P001FPK [1,0,0,0,0,0|1,0,1]=3 514 B9R1.6 [O-]C(=O)c1ccccn1 1P003PCW [1,0,0,0,0,0|1,0,1]=3 515 B9R1.6 [O-]C(=O)c1ccccn1 1P003U8R [1,0,0,0,0,0|1,0,1]=3 516 B9R1.6 [O-]C(=O)c1cccnc1 1P003UTW [1,0,0,0,0,0|1,0,1]=3 517 B9R1.6 [O-]C(=O)c1ccncc1 1P003US2 [1,0,0,0,0,0|1,0,1]=3 518 B9R1.6 [O-]C(=O)c1ccncn1 1P0055B7 [1,0,0,0,0,0|2,0,1]=4 519 B9R1.6 [O-]S(=O)c1ccccc1 1P002RKI [1,0,0,0,0,0|1,0,1]=3 520 B9R1.6 [O-]S(=O)c1ccccc1 1P00388M [1,0,0,0,0,0|1,0,1]=3 521 B9R1.6 [O-]S(=O)c1ccccc1 1P004L8X [1,0,0,0,0,0|1,0,1]=3 522 B9R1.6 [O-]S(=O)c1ccccn1 1P00I55G [1,0,0,0,0,0|2,0,1]=4 523 B9R1.6 [O-]S(=O)c1ccccn1 1P01AGPS [1,0,0,0,0,0|2,0,1]=4 524 B9R1.6 [O-]S(=O)c1cccnc1 1P00A6VE [1,0,0,0,0,0|2,0,1]=4 525 B9R1.6 [O-]S(=O)c1cccnc1 1P027XAI [1,0,0,0,0,0|2,0,1]=4 526 B9R1.6 [O-]S(=O)c1ccncc1 1P01FNTD [1,0,0,0,0,0|2,0,1]=4 527 B9R1.6 [O-][N+](=O)c1ccccn1 1P001MRG [1,0,0,0,0,0|2,0,1]=4 528 B9R1.6 [O-][N+](=O)c1cccnc1 1P003KAJ [1,0,0,0,0,0|2,0,1]=4 529 B9R1.6 [O-][N+](=O)c1ccncc1 1P007C8Z [1,0,0,0,0,0|2,0,1]=4 530 B9R1.15 BrCc1ccccc1Br 1P0033MT [1,0,0,0,0,0|2,0,1]=4 531 B9R1.15 BrCc1ccccc1C 1P0032QO [1,0,0,0,0,0|2,0,1]=4 532 B9R1.15 BrCc1ccccc1Cl 1P00IB9Q [1,0,0,0,0,0|2,0,1]=4 533 B9R1.15 BrCc1ccccc1F 1P0033SD [1,0,0,0,0,0|2,0,1]=4 534 B9R1.15 BrCc1ccccc1I 1P0073H5 [1,0,0,0,0,0|2,0,1]=4 535 B9R1.15 BrCc1cnccc1O 1P0291ZL [1,0,0,0,0,0|2,0,1]=4 536 B9R1.15 Br[Mg]c1ccccc1C 1P00IKYX [1,0,0,0,0,0|3,0,0]=4 537 B9R1.15 C#Cc1ccccc1Br 1P0033NH [1,0,0,0,0,0|2,0,1]=4 538 B9R1.15 C#Cc1ccccc1Cl 1P003379 [1,0,0,0,0,0|2,0,1]=4 539 B9R1.15 C#Cc1ccccc1F 1P003ESB [1,0,0,0,0,0|2,0,1]=4 540 B9R1.15 C#Cc1ccccc1N 1P00DG3G [1,0,0,0,0,0|2,0,1]=4 541 B9R1.15 C#Cc1ccccc1O 1P006V78 [1,0,0,0,0,0|1,0,1]=3 542 B9R1.15 C#Cc1cccnc1O 1P009GXT [1,0,0,0,0,0|2,0,1]=4 543 B9R1.15 C=Cc1ccccc1Br 1P0029NZ [1,0,0,0,0,0|2,0,0]=3 544 B9R1.15 C=Cc1ccccc1Cl 1P0029O0 [1,0,0,0,0,0|2,0,0]=3 545 B9R1.15 C=Cc1ccccc1F 1P0033SL [1,0,0,0,0,0|2,0,0]=3 546 B9R1.15 C=Cc1ccccc1I 1P006XAK [1,0,0,0,0,0|2,0,0]=3 547 B9R1.15 C=Cc1ccccc1N 1P0037RP [1,0,0,0,0,0|2,0,0]=3 548 B9R1.15 C=Cc1ccccc1N 1P00775F [1,0,0,0,0,0|2,0,0]=3 549 B9R1.15 C=Cc1cccnc1C 1P00I8ZR [1,0,0,0,0,0|3,0,0]=4 550 B9R1.15 C=Cc1cccnc1F 1P00HX8N [1,0,0,0,0,0|3,0,0]=4 551 B9R1.15 C=Cc1ccncc1Br 1P028WIA [1,0,0,0,0,0|3,0,0]=4 552 B9R1.15 C=Cc1ccncc1C 1P01C42S [1,0,0,0,0,0|3,0,0]=4 553 B9R1.15 C=Cc1ncccc1Br 1P004ZQ3 [1,0,0,0,0,0|3,0,0]=4 554 B9R1.15 C=Cc1ncccc1C 1P00CC7K [1,0,0,0,0,0|3,0,0]=4 555 B9R1.15 C=Cc1ncccc1F 1P01B626 [1,0,0,0,0,0|3,0,0]=4 556 B9R1.15 CCc1ccccc1Br 1P002B7A [1,0,0,0,0,0|2,0,1]=4 557 B9R1.15 CCc1ccccc1C 1P003HOX [1,0,0,0,0,0|2,0,1]=4 558 B9R1.15 CCc1ccccc1F 1P00DDKE [1,0,0,0,0,0|2,0,1]=4 559 B9R1.15 CCc1ccccc1I 1P0024MY [1,0,0,0,0,0|2,0,1]=4 560 B9R1.15 CCc1ccccc1N 1P0037MR [1,0,0,0,0,0|2,0,1]=4 561 B9R1.15 CCc1ccccc1S 1P003HO5 [1,0,0,0,0,0|1,1,1]=4 562 B9R1.15 CCc1cccnc1O 1P00EIVR [1,0,0,0,0,0|2,0,1]=4 563 B9R1.15 CCc1cnccc1O 1P00DYDN [1,0,0,0,0,0|2,0,1]=4 564 B9R1.15 CCc1ncccc1O 1P00EJRY [1,0,0,0,0,0|2,0,1]=4 565 B9R1.15 CNc1ccccc1Br 1P003H96 [1,0,0,0,0,0|3,0,0]=4 566 B9R1.15 CNc1ccccc1Br 1P00IJUS [1,0,0,0,0,0|3,0,0]=4 567 B9R1.15 CNc1ccccc1C 1P003TP2 [1,0,0,0,0,0|3,0,0]=4 568 B9R1.15 CNc1ccccc1Cl 1P006I47 [1,0,0,0,0,0|3,0,0]=4 569 B9R1.15 CNc1ccccc1F 1P002BI4 [1,0,0,0,0,0|3,0,0]=4 570 B9R1.15 CNc1ccccc1I 1P019XX6 [1,0,0,0,0,0|3,0,0]=4 571 B9R1.15 CNc1ccccc1N 1P002R3W [1,0,0,0,0,0|3,0,0]=4 572 B9R1.15 CNc1ccccc1N 1P003T4H [1,0,0,0,0,0|3,0,0]=4 573 B9R1.15 CNc1ccccc1O 1P0033UU [1,0,0,0,0,0|2,0,0]=3 574 B9R1.15 CNc1ccccc1O 1P01K0W3 [1,0,0,0,0,0|2,0,0]=3 575 B9R1.15 COc1ccccc1Br 1P003H81 [1,0,0,0,0,0|3,0,0]=4 576 B9R1.15 COc1ccccc1C 1P003I55 [1,0,0,0,0,0|3,0,0]=4 577 B9R1.15 COc1ccccc1Cl 1P0033PR [1,0,0,0,0,0|3,0,0]=4 578 B9R1.15 COc1ccccc1F 1P003HS1 [1,0,0,0,0,0|3,0,0]=4 579 B9R1.15 COc1ccccc1I 1P0033TS [1,0,0,0,0,0|3,0,0]=4 580 B9R1.15 COc1ccccc1N 1P003TWA [1,0,0,0,0,0|3,0,0]=4 581 B9R1.15 COc1ccccc1N 1P003TWB [1,0,0,0,0,0|3,0,0]=4 582 B9R1.15 COc1ccccc1O 1P003AR5 [1,0,0,0,0,0|2,0,0]=3 583 B9R1.15 COc1ccccc1S 1P0033UE [1,0,0,0,0,0|2,1,0]=4 584 B9R1.15 COc1cccnc1O 1P00I1BE [1,0,0,0,0,0|3,0,0]=4 585 B9R1.15 COc1ccncc1O 1P007IYM [1,0,0,0,0,0|3,0,0]=4 586 B9R1.15 COc1ncccc1O 1P009FJH [1,0,0,0,0,0|3,0,0]=4 587 B9R1.15 CSc1ccccc1Br 1P003H9R [1,0,0,0,0,0|3,0,0]=4 588 B9R1.15 CSc1ccccc1C 1P001G42 [1,0,0,0,0,0|3,0,0]=4 589 B9R1.15 CSc1ccccc1Cl 1P0025PI [1,0,0,0,0,0|3,0,0]=4 590 B9R1.15 CSc1ccccc1F 1P003HSY [1,0,0,0,0,0|3,0,0]=4 591 B9R1.15 CSc1ccccc1I 1P003HXO [1,0,0,0,0,0|3,0,0]=4 592 B9R1.15 CSc1ccccc1N 1P003BJ8 [1,0,0,0,0,0|3,0,0]=4 593 B9R1.15 CSc1ccccc1O 1P003HWT [1,0,0,0,0,0|2,0,0]=3 594 B9R1.15 ClCc1ccccc1Cl 1P003BO7 [1,0,0,0,0,0|2,0,1]=4 595 B9R1.15 ClCc1ccccc1F 1P003HSB [1,0,0,0,0,0|2,0,1]=4 596 B9R1.15 ClCc1ccccc1I 1P003DJH [1,0,0,0,0,0|2,0,1]=4 597 B9R1.15 ClCc1ncccc1O 1P005N12 [1,0,0,0,0,0|2,0,1]=4 598 B9R1.15 FCc1ccccc1Br 1P01JKVP [1,0,0,0,0,0|2,0,1]=4 599 B9R1.15 ICc1ccccc1Cl 1P005V3O [1,0,0,0,0,0|2,0,1]=4 600 B9R1.15 N#Cc1ccccc1Br 1P0029SV [1,0,0,0,0,0|2,0,1]=4 601 B9R1.15 N#Cc1ccccc1C 1P003A6S [1,0,0,0,0,0|2,0,1]=4 602 B9R1.15 N#Cc1ccccc1Cl 1P003HIG [1,0,0,0,0,0|2,0,1]=4 603 B9R1.15 N#Cc1ccccc1F 1P0033SC [1,0,0,0,0,0|2,0,1]=4 604 B9R1.15 N#Cc1ccccc1I 1P003HXH [1,0,0,0,0,0|2,0,1]=4 605 B9R1.15 N#Cc1ccccc1N 1P002HEF [1,0,0,0,0,0|2,0,1]=4 606 B9R1.15 N#Cc1ccccc1O 1P003HVY [1,0,0,0,0,0|1,0,1]=3 607 B9R1.15 N#Cc1cccnc1O 1P005X0B [1,0,0,0,0,0|2,0,1]=4 608 B9R1.15 N#Cc1ccncc1O 1P004KDV [1,0,0,0,0,0|2,0,1]=4 609 B9R1.15 N#Cc1cnccc1O 1P00GV46 [1,0,0,0,0,0|2,0,1]=4 610 B9R1.15 N#Cc1ncccc1O 1P0033QK [1,0,0,0,0,0|2,0,1]=4 611 B9R1.15 N#[N+]c1ccccc1Cl 1P021RNX [1,0,0,0,0,0|3,0,0]=4 612 B9R1.15 NCc1ccccc1Br 1P003H8D [1,0,0,0,0,0|2,0,1]=4 613 B9R1.15 NCc1ccccc1Br 1P003H8E [1,0,0,0,0,0|2,0,1]=4 614 B9R1.15 NCc1ccccc1C 1P0037DE [1,0,0,0,0,0|2,0,1]=4 615 B9R1.15 NCc1ccccc1Cl 1P0033PV [1,0,0,0,0,0|2,0,1]=4 616 B9R1.15 NCc1ccccc1Cl 1P00BGK2 [1,0,0,0,0,0|2,0,1]=4 617 B9R1.15 NCc1ccccc1F 1P0033SE [1,0,0,0,0,0|2,0,1]=4 618 B9R1.15 NCc1ccccc1I 1P007333 [1,0,0,0,0,0|2,0,1]=4 619 B9R1.15 NCc1ccccc1I 1P00C7RL [1,0,0,0,0,0|2,0,1]=4 620 B9R1.15 NCc1ccccc1N 1P00DEQ7 [1,0,0,0,0,0|2,0,1]=4 621 B9R1.15 NCc1ccccc1O 1P003FFO [1,0,0,0,0,0|1,0,1]=3 622 B9R1.15 NCc1ccccc1O 1P00EIWG [1,0,0,0,0,0|1,0,1]=3 623 B9R1.15 NCc1ccccc1O 1P01DLDC [1,0,0,0,0,0|1,0,1]=3 624 B9R1.15 NCc1ccncc1O 1P002A71 [1,0,0,0,0,0|2,0,1]=4 625 B9R1.15 NCc1cnccc1O 1P02056P [1,0,0,0,0,0|2,0,1]=4 626 B9R1.15 NCc1ncccc1O 1P00BBSC [1,0,0,0,0,0|2,0,1]=4 627 B9R1.15 NCc1ncccc1O 1P01FIC3 [1,0,0,0,0,0|2,0,1]=4 628 B9R1.15 NNc1ccccc1Br 1P001XRH [1,0,0,0,0,0|3,0,0]=4 629 B9R1.15 NNc1ccccc1Br 1P0033NI [1,0,0,0,0,0|3,0,0]=4 630 B9R1.15 NNc1ccccc1C 1P003TYZ [1,0,0,0,0,0|3,0,0]=4 631 B9R1.15 NNc1ccccc1Cl 1P0033Q9 [1,0,0,0,0,0|3,0,0]=4 632 B9R1.15 NNc1ccccc1F 1P002OLG [1,0,0,0,0,0|3,0,0]=4 633 B9R1.15 NNc1ccccc1F 1P002YAI [1,0,0,0,0,0|3,0,0]=4 634 B9R1.15 NNc1ccccc1I 1P00DBVY [1,0,0,0,0,0|3,0,0]=4 635 B9R1.15 NNc1ccccc1I 1P00EZL5 [1,0,0,0,0,0|3,0,0]=4 636 B9R1.15 NOc1ccccc1Cl 1P01B91N [1,0,0,0,0,0|3,0,0]=4 637 B9R1.15 NOc1ccccc1Cl 1P01BFN7 [1,0,0,0,0,0|3,0,0]=4 638 B9R1.15 NOc1ccccc1F 1P01BFN6 [1,0,0,0,0,0|3,0,0]=4 639 B9R1.15 O=Cc1c[nH]ccc1=N 1P01DU8B [1,0,0,0,0,0|2,0,0]=3 640 B9R1.15 O=Cc1ccccc1Br 1P003H83 [1,0,0,0,0,0|1,0,0]=2 641 B9R1.15 O=Cc1ccccc1C 1P0032QN [1,0,0,0,0,0|1,0,0]=2 642 B9R1.15 O=Cc1ccccc1Cl 1P0033PS [1,0,0,0,0,0|1,0,0]=2 643 B9R1.15 O=Cc1ccccc1F 1P003HS2 [1,0,0,0,0,0|1,0,0]=2 644 B9R1.15 O=Cc1ccccc1I 1P002SZ0 [1,0,0,0,0,0|1,0,0]=2 645 B9R1.15 O=Cc1ccccc1N 1P00I9WT [1,0,0,0,0,0|1,0,0]=2 646 B9R1.15 O=Cc1cccnc1Br 1P000Y70 [1,0,0,0,0,0|2,0,0]=3 647 B9R1.15 O=Cc1cccnc1C 1P00EDM2 [1,0,0,0,0,0|2,0,0]=3 648 B9R1.15 O=Cc1cccnc1Cl 1P003HC8 [1,0,0,0,0,0|2,0,0]=3 649 B9R1.15 O=Cc1cccnc1F 1P003991 [1,0,0,0,0,0|2,0,0]=3 650 B9R1.15 O=Cc1cccnc1N 1P0033JT [1,0,0,0,0,0|2,0,0]=3 651 B9R1.15 O=Cc1cccnc1O 1P01XDHM [1,0,0,0,0,0|1,0,0]=2 652 B9R1.15 O=Cc1ccncc1Br 1P003JII [1,0,0,0,0,0|2,0,0]=3 653 B9R1.15 O=Cc1ccncc1C 1P005AUA [1,0,0,0,0,0|2,0,0]=3 654 B9R1.15 O=Cc1ccncc1Cl 1P003JOU [1,0,0,0,0,0|2,0,0]=3 655 B9R1.15 O=Cc1ccncc1F 1P003463 [1,0,0,0,0,0|2,0,0]=3 656 B9R1.15 O=Cc1ccncc1N 1P00DEZT [1,0,0,0,0,0|2,0,0]=3 657 B9R1.15 O=Cc1ccncc1O 1P00757U [1,0,0,0,0,0|1,0,0]=2 658 B9R1.15 O=Cc1cnccc1Br 1P000G6U [1,0,0,0,0,0|2,0,0]=3 659 B9R1.15 O=Cc1cnccc1Br 1P00AP7I [1,0,0,0,0,0|2,0,0]=3 660 B9R1.15 O=Cc1cnccc1C 1P00D9CN [1,0,0,0,0,0|2,0,0]=3 661 B9R1.15 O=Cc1cnccc1Cl 1P000AXW [1,0,0,0,0,0|2,0,0]=3 662 B9R1.15 O=Cc1cnccc1N 1P0037OR [1,0,0,0,0,0|2,0,0]=3 663 B9R1.15 O=Cc1cnccc1N 1P00619R [1,0,0,0,0,0|2,0,0]=3 664 B9R1.15 O=Cc1cnccc1O 1P0036Q3 [1,0,0,0,0,0|1,0,0]=2 665 B9R1.15 O=Cc1cncnc1N 1P001UPA [1,0,0,0,0,0|3,0,0]=4 666 B9R1.15 O=Cc1ncccc1Br 1P00342J [1,0,0,0,0,0|2,0,0]=3 667 B9R1.15 O=Cc1ncccc1C 1P003K64 [1,0,0,0,0,0|2,0,0]=3 668 B9R1.15 O=Cc1ncccc1Cl 1P002B0R [1,0,0,0,0,0|2,0,0]=3 669 B9R1.15 O=Cc1ncccc1F 1P00346F [1,0,0,0,0,0|2,0,0]=3 670 B9R1.15 O=Cc1ncccc1N 1P0037JT [1,0,0,0,0,0|2,0,0]=3 671 B9R1.15 O=Cc1ncccc1O 1P007SB0 [1,0,0,0,0,0|1,0,0]=2 672 B9R1.15 O=Cc1nccnc1C 1P00BGLJ [1,0,0,0,0,0|3,0,0]=4 673 B9R1.15 O=Cc1nccnc1Cl 1P0081RE [1,0,0,0,0,0|3,0,0]=4 674 B9R1.15 O=Cc1nccnc1F 1P00I4F3 [1,0,0,0,0,0|3,0,0]=4 675 B9R1.15 O=Cc1nccnc1N 1P0039AI [1,0,0,0,0,0|3,0,0]=4 676 B9R1.15 O=Cc1ncncc1C 1P01EMMI [1,0,0,0,0,0|3,0,0]=4 677 B9R1.15 O=Cc1ncncc1N 1P00II0O [1,0,0,0,0,0|3,0,0]=4 678 B9R1.15 O=Nc1ccccc1C 1P00EG52 [1,0,0,0,0,0|2,0,0]=3 679 B9R1.15 O=c1c(C=O)ccc[nH]1 1P003HWG [1,0,0,0,0,0|1,0,1]=3 680 B9R1.15 OCc1ccc[nH]c1=O 1P00C95U [1,0,0,0,0,0|1,0,2]=4 681 B9R1.15 OCc1cccc[n+]1C 1P007HR4 [1,0,0,0,0,0|2,0,1]=4 682 B9R1.15 OCc1ccccc1Br 1P002EHD [1,0,0,0,0,0|1,0,1]=3 683 B9R1.15 OCc1ccccc1Br 1P004WEF [1,0,0,0,0,0|1,0,1]=3 684 B9R1.15 OCc1ccccc1C 1P003I5H [1,0,0,0,0,0|1,0,1]=3 685 B9R1.15 OCc1ccccc1Cl 1P0026K3 [1,0,0,0,0,0|1,0,1]=3 686 B9R1.15 OCc1ccccc1F 1P003BOX [1,0,0,0,0,0|1,0,1]=3 687 B9R1.15 OCc1ccccc1I 1P00DF4T [1,0,0,0,0,0|1,0,1]=3 688 B9R1.15 OCc1ccccc1N 1P0033KS [1,0,0,0,0,0|1,0,1]=3 689 B9R1.15 OCc1ccccc1O 1P00IGEK [1,0,0,0,0,0|0,0,1]=2 690 B9R1.15 OCc1ccccc1S 1P003HZ0 [1,0,0,0,0,0|0,1,1]=3 691 B9R1.15 OCc1cccnc1Br 1P001054 [1,0,0,0,0,0|2,0,1]=4 692 B9R1.15 OCc1cccnc1C 1P003BPS [1,0,0,0,0,0|2,0,1]=4 693 B9R1.15 OCc1cccnc1Cl 1P003C3A [1,0,0,0,0,0|2,0,1]=4 694 B9R1.15 OCc1cccnc1F 1P001053 [1,0,0,0,0,0|2,0,1]=4 695 B9R1.15 OCc1cccnc1N 1P002OD6 [1,0,0,0,0,0|2,0,1]=4 696 B9R1.15 OCc1ccncc1Br 1P001EO2 [1,0,0,0,0,0|2,0,1]=4 697 B9R1.15 OCc1ccncc1C 1P00C847 [1,0,0,0,0,0|2,0,1]=4 698 B9R1.15 OCc1ccncc1Cl 1P003C8S [1,0,0,0,0,0|2,0,1]=4 699 B9R1.15 OCc1ccncc1F 1P008EEG [1,0,0,0,0,0|2,0,1]=4 700 B9R1.15 OCc1ccncc1N 1P007K0Z [1,0,0,0,0,0|2,0,1]=4 701 B9R1.15 OCc1ccncc1O 1P00C7AH [1,0,0,0,0,0|1,0,1]=3 702 B9R1.15 OCc1cnccc1Br 1P00AQMY [1,0,0,0,0,0|2,0,1]=4 703 B9R1.15 OCc1cnccc1C 1P00D9CV [1,0,0,0,0,0|2,0,1]=4 704 B9R1.15 OCc1cnccc1Cl 1P002E5M [1,0,0,0,0,0|2,0,1]=4 705 B9R1.15 OCc1cnccc1Cl 1P002OUG [1,0,0,0,0,0|2,0,1]=4 706 B9R1.15 OCc1cnccc1N 1P0018HB [1,0,0,0,0,0|2,0,1]=4 707 B9R1.15 OCc1ncccc1Br 1P0037LG [1,0,0,0,0,0|2,0,1]=4 708 B9R1.15 OCc1ncccc1C 1P00E9TF [1,0,0,0,0,0|2,0,1]=4 709 B9R1.15 OCc1ncccc1Cl 1P00ED23 [1,0,0,0,0,0|2,0,1]=4 710 B9R1.15 OCc1ncccc1F 1P00BETC [1,0,0,0,0,0|2,0,1]=4 711 B9R1.15 OCc1ncccc1N 1P003JAQ [1,0,0,0,0,0|2,0,1]=4 712 B9R1.15 OCc1ncccc1O 1P001CZ5 [1,0,0,0,0,0|1,0,1]=3 713 B9R1.15 OCc1ncccc1O 1P001HER [1,0,0,0,0,0|1,0,1]=3 714 B9R1.15 ONc1ccccc1Cl 1P007HD5 [1,0,0,0,0,0|2,0,0]=3 715 B9R1.15 SCc1ccccc1Br 1P001J1L [1,0,0,0,0,0|1,1,1]=4 716 B9R1.15 SCc1ccccc1C 1P003B52 [1,0,0,0,0,0|1,1,1]=4 717 B9R1.15 SCc1ccccc1Cl 1P003HIA [1,0,0,0,0,0|1,1,1]=4 718 B9R1.15 SCc1ccccc1F 1P00FDHP [1,0,0,0,0,0|1,1,1]=4 719 B9R1.15 SCc1ccccc1N 1P0284O8 [1,0,0,0,0,0|1,1,1]=4 720 B9R1.15 [C-]#[N+]c1ccccc1Br 1P0027V3 [1,0,0,0,0,0|3,0,0]=4 721 B9R1.15 [C-]#[N+]c1ccccc1C 1P008T4R [1,0,0,0,0,0|3,0,0]=4 722 B9R1.15 [C-]#[N+]c1ccccc1I 1P00I1VF [1,0,0,0,0,0|3,0,0]=4 723 B11R1.53 BrCc1ccccc1B(O)O 1P003H8T [0,1,0,0,0,0|2,0,1]=4 724 B11R1.53 BrCc1ccccc1C(=O)O 1P003FGO [0,1,0,0,0,0|1,0,0]=2 725 B11R1.53 BrCc1ccccc1N(=O)=O 1P0033VK [0,1,0,0,0,0|2,0,1]=4 726 B11R1.53 C#Cc1ccccc1B(O)O 1P00GXY6 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.53 C#Cc1ccccc1C(=O)C 1P0095DR [0,1,0,0,0,0|2,0,0]=3 728 B11R1.53 C#Cc1ccccc1C(=O)O 1P00C16W [0,1,0,0,0,0|1,0,0]=2 729 B11R1.53 C#Cc1ccccc1[N+](=O)[O-] 1P001V9R [0,1,0,0,0,0|2,0,1]=4 730 B11R1.53 C=Cc1ccccc1B(O)O 1P001MU4 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.53 C=Cc1ccccc1C(=O)C 1P00DTOA [0,1,0,0,0,0|2,0,0]=3 732 B11R1.53 C=Cc1ccccc1[N+](=O)[O-] 1P00EKKK [0,1,0,0,0,0|2,0,1]=4 733 B11R1.53 CCc1ccccc1B(O)O 1P003HOT [0,1,0,0,0,0|2,0,1]=4 734 B11R1.53 CCc1ccccc1C(=O)C 1P0039TF [0,1,0,0,0,0|2,0,0]=3 735 B11R1.53 CCc1ccccc1C(=O)N 1P006JB8 [0,1,0,0,0,0|2,0,0]=3 736 B11R1.53 CCc1ccccc1C(=O)O 1P0036IN [0,1,0,0,0,0|1,0,0]=2 737 B11R1.53 CCc1ccccc1S(=O)C 1P002U15 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.53 CCc1ccccc1[N+](=O)[O-] 1P003HOR [0,1,0,0,0,0|2,0,1]=4 739 B11R1.53 CCc1cccnc1C(=O)C 1P01A4AN [0,1,0,0,0,0|3,0,0]=4 740 B11R1.53 CCc1cccnc1C(=O)O 1P01A48I [0,1,0,0,0,0|2,0,0]=3 741 B11R1.53 CCc1ccncc1C(=O)O 1P00E364 [0,1,0,0,0,0|2,0,0]=3 742 B11R1.53 CCc1cnccc1C(=O)C 1P00CU65 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.53 CCc1cnccc1C(=O)O 1P00CIEU [0,1,0,0,0,0|2,0,0]=3 744 B11R1.53 CCc1cnccc1C(=O)O 1P01A3UL [0,1,0,0,0,0|2,0,0]=3 745 B11R1.53 CCc1ncccc1C(=O)O 1P003KCW [0,1,0,0,0,0|2,0,0]=3 746 B11R1.53 CCc1ncccc1C(=O)O 1P028FW1 [0,1,0,0,0,0|2,0,0]=3 747 B11R1.53 CCc1nccnc1C(=O)O 1P0292OU [0,1,0,0,0,0|3,0,0]=4 748 B11R1.53 CCc1ncncc1C(=O)O 1P019VM6 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.53 CNc1ccccc1C(=O)C 1P00AM66 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.53 CNc1ccccc1C(=O)N 1P005F2G [0,1,0,0,0,0|2,0,0]=3 751 B11R1.53 CNc1ccccc1C(=O)O 1P000PGJ [0,1,0,0,0,0|1,0,0]=2 752 B11R1.53 CNc1ccccc1[N+](=O)[O-] 1P00E9IB [0,1,0,0,0,0|2,0,1]=4 753 B11R1.53 CNc1cnccc1C(=O)O 1P001E7S [0,1,0,0,0,0|2,0,0]=3 754 B11R1.53 CNc1cnncc1C(=O)O 1P028GMI [0,1,0,0,0,0|3,0,0]=4 755 B11R1.53 CNc1ncccc1C(=O)N 1P009T1Y [0,1,0,0,0,0|3,0,0]=4 756 B11R1.53 CNc1ncccc1C(=O)O 1P00C64E [0,1,0,0,0,0|2,0,0]=3 757 B11R1.53 COc1ccccc1B(O)O 1P003I0F [0,1,0,0,0,0|1,0,1]=3 758 B11R1.53 COc1ccccc1C(=C)C 1P02495N [0,1,0,0,0,0|2,0,0]=3 759 B11R1.53 COc1ccccc1C(=C)F 1P0014A1 [0,1,0,0,0,0|2,0,0]=3 760 B11R1.53 COc1ccccc1C(=N)N 1P00AODY [0,1,0,0,0,0|2,0,0]=3 761 B11R1.53 COc1ccccc1C(=N)N 1P00D8T7 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.53 COc1ccccc1C(=N)N 1P00EKGE [0,1,0,0,0,0|2,0,0]=3 763 B11R1.53 COc1ccccc1C(=O)C 1P0032QL [0,1,0,0,0,0|1,0,0]=2 764 B11R1.53 COc1ccccc1C(=O)Cl 1P003TWC [0,1,0,0,0,0|1,0,0]=2 765 B11R1.53 COc1ccccc1C(=O)N 1P003I0E [0,1,0,0,0,0|1,0,0]=2 766 B11R1.53 COc1ccccc1C(=O)O 1P0035VZ [0,1,0,0,0,0|0,0,0]=1 767 B11R1.53 COc1ccccc1C(=S)N 1P003I1C [0,1,0,0,0,0|1,1,0]=3 768 B11R1.53 COc1ccccc1C(C)C 1P002YUN [0,1,0,0,0,0|2,0,1]=4 769 B11R1.53 COc1ccccc1C(Cl)C 1P01A323 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.53 COc1ccccc1C(N)C 1P003DBT [0,1,0,0,0,0|2,0,1]=4 771 B11R1.53 COc1ccccc1C(N)C 1P00ASQB [0,1,0,0,0,0|2,0,1]=4 772 B11R1.53 COc1ccccc1C(O)C 1P003DBS [0,1,0,0,0,0|1,0,1]=3 773 B11R1.53 COc1ccccc1C(S)C 1P019SPI [0,1,0,0,0,0|1,1,1]=4 774 B11R1.53 COc1ccccc1N(=O)=O 1P003BQ1 [0,1,0,0,0,0|1,0,1]=3 775 B11R1.53 COc1ccccc1S(=O)O 1P00AJN2 [0,1,0,0,0,0|1,0,0]=2 776 B11R1.53 COc1ccccc1[C@@H](N)C 1P001500 [0,1,0,0,0,0|2,0,1]=4 777 B11R1.53 COc1ccccc1[C@@H](N)C 1P003CZC [0,1,0,0,0,0|2,0,1]=4 778 B11R1.53 COc1ccccc1[C@@H](O)C 1P008SU6 [0,1,0,0,0,0|1,0,1]=3 779 B11R1.53 COc1ccccc1[C@H](N)C 1P003CNJ [0,1,0,0,0,0|2,0,1]=4 780 B11R1.53 COc1ccccc1[C@H](N)C 1P0068LG [0,1,0,0,0,0|2,0,1]=4 781 B11R1.53 COc1ccccc1[C@H](O)C 1P0009WV [0,1,0,0,0,0|1,0,1]=3 782 B11R1.53 COc1cccnc1B(O)O 1P00I9EO [0,1,0,0,0,0|2,0,1]=4 783 B11R1.53 COc1cccnc1C(=O)C 1P00CJ7A [0,1,0,0,0,0|2,0,0]=3 784 B11R1.53 COc1cccnc1C(=O)O 1P001VJY [0,1,0,0,0,0|1,0,0]=2 785 B11R1.53 COc1cccnc1[N+](=O)[O-] 1P003K3G [0,1,0,0,0,0|2,0,1]=4 786 B11R1.53 COc1ccncc1B(O)O 1P000OK6 [0,1,0,0,0,0|2,0,1]=4 787 B11R1.53 COc1ccncc1B(O)O 1P0032TL [0,1,0,0,0,0|2,0,1]=4 788 B11R1.53 COc1ccncc1B(O)O 1P003AP3 [0,1,0,0,0,0|2,0,1]=4 789 B11R1.53 COc1ccncc1C(=O)C 1P002FW4 [0,1,0,0,0,0|2,0,0]=3 790 B11R1.53 COc1ccncc1C(=O)N 1P005ZJS [0,1,0,0,0,0|2,0,0]=3 791 B11R1.53 COc1ccncc1C(=O)O 1P0005WN [0,1,0,0,0,0|1,0,0]=2 792 B11R1.53 COc1ccncc1C(=S)N 1P0288JF [0,1,0,0,0,0|2,1,0]=4 793 B11R1.53 COc1ccncc1[N+](=O)[O-] 1P007IMW [0,1,0,0,0,0|2,0,1]=4 794 B11R1.53 COc1ccncc1[N+](=O)[O-] 1P00BYXZ [0,1,0,0,0,0|2,0,1]=4 795 B11R1.53 COc1cnccc1B(O)O 1P0003H2 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.53 COc1cnccc1B(O)O 1P003C9E [0,1,0,0,0,0|2,0,1]=4 797 B11R1.53 COc1cnccc1C(=O)C 1P008I9M [0,1,0,0,0,0|2,0,0]=3 798 B11R1.53 COc1cnccc1C(=O)O 1P00347E [0,1,0,0,0,0|1,0,0]=2 799 B11R1.53 COc1cnccc1[N+](=O)[O-] 1P009KBG [0,1,0,0,0,0|2,0,1]=4 800 B11R1.53 COc1cncnc1C(=O)O 1P01DNLM [0,1,0,0,0,0|2,0,0]=3 801 B11R1.53 COc1cnncc1C(=O)O 1P028UKL [0,1,0,0,0,0|2,0,0]=3 802 B11R1.53 COc1ncccc1B(O)O 1P001U7S [0,1,0,0,0,0|2,0,1]=4 803 B11R1.53 COc1ncccc1C(=O)C 1P00100M [0,1,0,0,0,0|2,0,0]=3 804 B11R1.53 COc1ncccc1C(=O)N 1P0068DO [0,1,0,0,0,0|2,0,0]=3 805 B11R1.53 COc1ncccc1C(=O)O 1P001VO2 [0,1,0,0,0,0|1,0,0]=2 806 B11R1.53 COc1ncccc1C(=S)N 1P01AB2U [0,1,0,0,0,0|2,1,0]=4 807 B11R1.53 COc1ncccc1C(O)C 1P008Y6C [0,1,0,0,0,0|2,0,1]=4 808 B11R1.53 COc1ncccc1[C@@H](O)C 1P028DMW [0,1,0,0,0,0|2,0,1]=4 809 B11R1.53 COc1ncccc1[C@H](O)C 1P0290F9 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.53 COc1ncccc1[N+](=O)[O-] 1P0038NN [0,1,0,0,0,0|2,0,1]=4 811 B11R1.53 COc1nccnc1C(=O)O 1P0038CU [0,1,0,0,0,0|2,0,0]=3 812 B11R1.53 COc1ncncc1C(=O)O 1P003M5Q [0,1,0,0,0,0|2,0,0]=3 813 B11R1.53 CSc1ccccc1B(O)O 1P001YNS [0,1,0,0,0,0|1,1,1]=4 814 B11R1.53 CSc1ccccc1C(=O)C 1P001JET [0,1,0,0,0,0|1,1,0]=3 815 B11R1.53 CSc1ccccc1C(=O)O 1P003FK5 [0,1,0,0,0,0|0,1,0]=2 816 B11R1.53 CSc1ccccc1C(O)C 1P01B95I [0,1,0,0,0,0|1,1,1]=4 817 B11R1.53 CSc1ccccc1[C@@H](O)C 1P01B8YM [0,1,0,0,0,0|1,1,1]=4 818 B11R1.53 CSc1ccccc1[C@H](O)C 1P01B91J [0,1,0,0,0,0|1,1,1]=4 819 B11R1.53 CSc1ccccc1[N+](=O)[O-] 1P00311U [0,1,0,0,0,0|1,1,1]=4 820 B11R1.53 CSc1cccnc1C(=O)O 1P01C5LN [0,1,0,0,0,0|1,1,0]=3 821 B11R1.53 CSc1ncccc1C(=O)O 1P003FKD [0,1,0,0,0,0|1,1,0]=3 822 B11R1.53 CSc1nccnc1C(=O)O 1P01BU2C [0,1,0,0,0,0|2,1,0]=4 823 B11R1.53 ClCc1ccccc1C(=O)Cl 1P00IMVP [0,1,0,0,0,0|2,0,0]=3 824 B11R1.53 ClCc1ccccc1C(=O)O 1P008GQF [0,1,0,0,0,0|1,0,0]=2 825 B11R1.53 ClSc1ccccc1[N+](=O)[O-] 1P003I91 [0,1,0,0,0,0|1,1,1]=4 826 B11R1.53 FCc1ccccc1C(=O)O 1P01BCSG [0,1,0,0,0,0|1,0,0]=2 827 B11R1.53 FCc1ccccc1[N+](=O)[O-] 1P01JKWA [0,1,0,0,0,0|2,0,1]=4 828 B11R1.53 N#Cc1ccccc1B(O)O 1P0019E9 [0,1,0,0,0,0|2,0,1]=4 829 B11R1.53 N#Cc1ccccc1C(=N)N 1P00I8PO [0,1,0,0,0,0|3,0,0]=4 830 B11R1.53 N#Cc1ccccc1C(=O)C 1P00GS4B [0,1,0,0,0,0|2,0,0]=3 831 B11R1.53 N#Cc1ccccc1C(=O)N 1P003HKW [0,1,0,0,0,0|2,0,0]=3 832 B11R1.53 N#Cc1ccccc1C(=O)O 1P0033QN [0,1,0,0,0,0|1,0,0]=2 833 B11R1.53 N#Cc1ccccc1C(O)C 1P0024R7 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.53 N#Cc1ccccc1S(=O)[O-] 1P01C8NW [0,1,0,0,0,0|2,0,1]=4 835 B11R1.53 N#Cc1ccccc1[N+](=O)[O-] 1P003I95 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.53 N#Cc1cccnc1C(=O)C 1P0280JD [0,1,0,0,0,0|3,0,0]=4 837 B11R1.53 N#Cc1cccnc1C(=O)O 1P003JT8 [0,1,0,0,0,0|2,0,0]=3 838 B11R1.53 N#Cc1ccncc1C(=O)O 1P004YLB [0,1,0,0,0,0|2,0,0]=3 839 B11R1.53 N#Cc1cnccc1C(=O)O 1P0084WZ [0,1,0,0,0,0|2,0,0]=3 840 B11R1.53 N#Cc1ncccc1C(=O)O 1P0038XD [0,1,0,0,0,0|2,0,0]=3 841 B11R1.53 NCc1ccccc1B(O)O 1P002Q22 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.53 NCc1ccccc1B(O)O 1P00G7GK [0,1,0,0,0,0|2,0,1]=4 843 B11R1.53 NCc1ccccc1C(=O)O 1P0001MC [0,1,0,0,0,0|1,0,0]=2 844 B11R1.53 NCc1ccccc1C(O)C 1P027XGK [0,1,0,0,0,0|2,0,1]=4 845 B11R1.53 NCc1ccccc1[N+](=O)[O-] 1P002F0F [0,1,0,0,0,0|2,0,1]=4 846 B11R1.53 NCc1ccccc1[N+](=O)[O-] 1P002Q2P [0,1,0,0,0,0|2,0,1]=4 847 B11R1.53 NCc1cccnc1C(=O)O 1P028WR5 [0,1,0,0,0,0|2,0,0]=3 848 B11R1.53 NCc1ncccc1C(=O)O 1P01FIWH [0,1,0,0,0,0|2,0,0]=3 849 B11R1.53 NNc1ccccc1C(=O)N 1P01BDPR [0,1,0,0,0,0|2,0,0]=3 850 B11R1.53 NNc1ccccc1C(=O)O 1P0033SQ [0,1,0,0,0,0|1,0,0]=2 851 B11R1.53 NNc1ccccc1N(=O)=O 1P00IKXO [0,1,0,0,0,0|2,0,1]=4 852 B11R1.53 NNc1ccccc1[N+](=O)[O-] 1P00309C [0,1,0,0,0,0|2,0,1]=4 853 B11R1.53 NNc1ccccc1[N+](=O)[O-] 1P003I9Q [0,1,0,0,0,0|2,0,1]=4 854 B11R1.53 NSc1ccccc1[N+](=O)[O-] 1P005R60 [0,1,0,0,0,0|1,1,1]=4 855 B11R1.53 O=Cc1ccccc1B(O)O 1P0036MD [0,1,0,0,0,0|1,0,2]=4 856 B11R1.53 O=Cc1ccccc1C(=O)C 1P003GRZ [0,1,0,0,0,0|1,0,1]=3 857 B11R1.53 O=Cc1ccccc1C(=O)N 1P004GQ3 [0,1,0,0,0,0|1,0,1]=3 858 B11R1.53 O=Cc1ccccc1C(=O)O 1P000PGK [0,1,0,0,0,0|0,0,1]=2 859 B11R1.53 O=Cc1ccccc1[N+](=O)[O-] 1P0033VJ [0,1,0,0,0,0|1,0,2]=4 860 B11R1.53 O=Cc1cccnc1C(=O)O 1P007S77 [0,1,0,0,0,0|1,0,1]=3 861 B11R1.53 O=Cc1cccnc1C(=O)O 1P028AKF [0,1,0,0,0,0|1,0,1]=3 862 B11R1.53 O=Cc1ncccc1C(=O)O 1P002O9P [0,1,0,0,0,0|1,0,1]=3 863 B11R1.53 O=[I]c1ccccc1C(=O)O 1P0030GH [0,1,0,0,0,0|0,0,1]=2 864 B11R1.53 OCc1ccccc1B(O)O 1P004O13 [0,1,0,0,0,0|1,0,1]=3 865 B11R1.53 OCc1ccccc1C(=C)C 1P01XCHW [0,1,0,0,0,0|2,0,0]=3 866 B11R1.53 OCc1ccccc1C(=O)N 1P00D1PU [0,1,0,0,0,0|1,0,0]=2 867 B11R1.53 OCc1ccccc1C(F)F 1P00HA48 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.53 OCc1ccccc1C(O)C 1P00EJIU [0,1,0,0,0,0|1,0,1]=3 869 B11R1.53 OCc1ccccc1N(C)C 1P00DLNK [0,1,0,0,0,0|3,0,0]=4 870 B11R1.53 OCc1ccccc1[N+](=O)[O-] 1P00IBA7 [0,1,0,0,0,0|1,0,1]=3 871 B11R1.53 OCc1cccnc1C(=O)N 1P009V80 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.53 OCc1cccnc1C(=O)[O-] 1P01FIAY [0,1,0,0,0,0|1,0,1]=3 873 B11R1.53 OCc1ncccc1C(=O)N 1P0091ZS [0,1,0,0,0,0|2,0,0]=3 874 B11R1.53 OCc1ncccc1C(=O)[O-] 1P01EMT9 [0,1,0,0,0,0|1,0,1]=3 875 B11R1.53 OCc1ncccc1N(=O)=O 1P00I7PY [0,1,0,0,0,0|2,0,1]=4 876 B11R1.53 OCc1nccnc1C(=O)N 1P01DWVB [0,1,0,0,0,0|3,0,0]=4 877 B11R1.53 SCc1ccccc1[N+](=O)[O-] 1P00D41R [0,1,0,0,0,0|1,1,1]=4 878 B11R1.87 Brc1ccccc1C(O)(C)C 1P005T88 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.87 Brc1ccccc1P(=O)(C)C 1P023R9H [0,1,0,0,0,0|3,0,0]=4 880 B11R1.87 Brc1ccccc1S(=O)(=N)C 1P01BAZV [0,1,0,0,0,0|3,0,0]=4 881 B11R1.87 Brc1ccccc1S(=O)(=N)N 1P0284W0 [0,1,0,0,0,0|3,0,0]=4 882 B11R1.87 Brc1ccccc1S(=O)(=O)C 1P003H9C [0,1,0,0,0,0|2,0,1]=4 883 B11R1.87 Brc1ccccc1S(=O)(=O)Cl 1P002VSV [0,1,0,0,0,0|2,0,1]=4 884 B11R1.87 Brc1ccccc1S(=O)(=O)F 1P00HVCI [0,1,0,0,0,0|2,0,1]=4 885 B11R1.87 Brc1ccccc1S(=O)(=O)N 1P0061LW [0,1,0,0,0,0|2,0,1]=4 886 B11R1.87 Cc1ccccc1C(O)(C)C 1P00GG36 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.87 Cc1ccccc1S(=O)(=N)C 1P01B7K2 [0,1,0,0,0,0|3,0,0]=4 888 B11R1.87 Cc1ccccc1S(=O)(=N)N 1P02850T [0,1,0,0,0,0|3,0,0]=4 889 B11R1.87 Cc1ccccc1S(=O)(=N)N 1P02856S [0,1,0,0,0,0|3,0,0]=4 890 B11R1.87 Cc1ccccc1S(=O)(=O)Cl 1P0011XT [0,1,0,0,0,0|2,0,1]=4 891 B11R1.87 Cc1ccccc1S(=O)(=O)F 1P01AN3I [0,1,0,0,0,0|2,0,1]=4 892 B11R1.87 Cc1ccccc1S(=O)(=O)N 1P0033UV [0,1,0,0,0,0|2,0,1]=4 893 B11R1.87 Cc1ccccc1S(=O)(=O)O 1P002FOQ [0,1,0,0,0,0|2,0,0]=3 894 B11R1.87 Cc1ccccc1S(=O)(=O)O 1P006GJS [0,1,0,0,0,0|2,0,0]=3 895 B11R1.87 Cc1ccccc1S(=O)(=O)O 1P00829J [0,1,0,0,0,0|2,0,0]=3 896 B11R1.87 Cc1ccccc1S(=O)(=O)O 1P00GTBY [0,1,0,0,0,0|2,0,0]=3 897 B11R1.87 Cc1cccnc1S(=O)(=O)O 1P002FOU [0,1,0,0,0,0|3,0,0]=4 898 B11R1.87 Cc1ccncc1S(=O)(=O)O 1P006YH1 [0,1,0,0,0,0|3,0,0]=4 899 B11R1.87 Clc1ccccc1C(O)(C)C 1P00CMYR [0,1,0,0,0,0|2,0,1]=4 900 B11R1.87 Clc1ccccc1S(=O)(=N)C 1P01BVT5 [0,1,0,0,0,0|3,0,0]=4 901 B11R1.87 Clc1ccccc1S(=O)(=O)C 1P0020FN [0,1,0,0,0,0|2,0,1]=4 902 B11R1.87 Clc1ccccc1S(=O)(=O)Cl 1P002VSX [0,1,0,0,0,0|2,0,1]=4 903 B11R1.87 Clc1ccccc1S(=O)(=O)O 1P003ACK [0,1,0,0,0,0|2,0,0]=3 904 B11R1.87 Clc1ccncc1S(=O)(=O)O 1P00DFFJ [0,1,0,0,0,0|3,0,0]=4 905 B11R1.87 Fc1ccccc1C(O)(C)C 1P00CMAM [0,1,0,0,0,0|2,0,1]=4 906 B11R1.87 Fc1ccccc1P(=O)(C)C 1P028NDT [0,1,0,0,0,0|3,0,0]=4 907 B11R1.87 Fc1ccccc1S(=O)(=N)C 1P01BAZX [0,1,0,0,0,0|3,0,0]=4 908 B11R1.87 Fc1ccccc1S(=O)(=O)Cl 1P002VSY [0,1,0,0,0,0|2,0,1]=4 909 B11R1.87 Fc1ccccc1S(=O)(=O)F 1P00E2XD [0,1,0,0,0,0|2,0,1]=4 910 B11R1.87 Fc1ccccc1S(=O)(=O)N 1P00BC5A [0,1,0,0,0,0|2,0,1]=4 911 B11R1.87 Ic1ccccc1C(O)(C)C 1P00G1HE [0,1,0,0,0,0|2,0,1]=4 912 B11R1.87 Ic1ccccc1P(=O)(C)C 1P028TGK [0,1,0,0,0,0|3,0,0]=4 913 B11R1.87 Ic1ccccc1S(=O)(=O)Cl 1P003HXE [0,1,0,0,0,0|2,0,1]=4 914 B11R1.87 Ic1ccccc1S(=O)(=O)F 1P028NQA [0,1,0,0,0,0|2,0,1]=4 915 B11R1.87 Ic1ccccc1S(=O)(=O)N 1P00E459 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.87 Ic1ccccc1S(=O)(=O)O 1P00IBLY [0,1,0,0,0,0|2,0,0]=3 917 B11R1.87 Ic1ccccc1S(=O)(=O)[O-] 1P003HXG [0,1,0,0,0,0|2,0,1]=4 918 B11R1.87 Nc1ccccc1C(O)(C)C 1P001QKV [0,1,0,0,0,0|2,0,1]=4 919 B11R1.87 Nc1ccccc1P(=O)(C)C 1P000Q49 [0,1,0,0,0,0|3,0,0]=4 920 B11R1.87 Nc1ccccc1P(=O)(O)O 1P005A6B [0,1,0,0,0,0|2,0,0]=3 921 B11R1.87 Nc1ccccc1S(=O)(=N)C 1P021O37 [0,1,0,0,0,0|3,0,0]=4 922 B11R1.87 Nc1ccccc1S(=O)(=O)C 1P00BJJX [0,1,0,0,0,0|2,0,1]=4 923 B11R1.87 Nc1ccccc1S(=O)(=O)F 1P00COWT [0,1,0,0,0,0|2,0,1]=4 924 B11R1.87 Nc1ccccc1S(=O)(=O)N 1P00384C [0,1,0,0,0,0|2,0,1]=4 925 B11R1.87 Nc1ccccc1S(=O)(=O)O 1P0033KP [0,1,0,0,0,0|2,0,0]=3 926 B11R1.87 Oc1ccccc1C(C)(C)C 1P003IEG [0,1,0,0,0,0|2,0,1]=4 927 B11R1.87 Oc1ccccc1C(F)(F)F 1P003O7V [0,1,0,0,0,0|2,0,1]=4 928 B11R1.87 Oc1ccccc1C(N)(C)C 1P028VWD [0,1,0,0,0,0|2,0,1]=4 929 B11R1.87 Oc1ccccc1C(O)(C)C 1P00BJQG [0,1,0,0,0,0|1,0,1]=3 930 B11R1.87 Oc1ccccc1P(=O)(C)C 1P0292Z6 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.87 Oc1ccccc1S(=O)(=O)C 1P00BESN [0,1,0,0,0,0|1,0,1]=3 932 B11R1.87 Oc1ccccc1S(=O)(=O)F 1P01B5GQ [0,1,0,0,0,0|1,0,1]=3 933 B11R1.87 Oc1ccccc1S(=O)(=O)N 1P00CMKX [0,1,0,0,0,0|1,0,1]=3 934 B11R1.87 Oc1ccccc1[B-](F)(F)F 1P003HWN [0,1,0,0,0,0|3,0,0]=4 935 B11R1.87 Oc1ccccc1[Si](C)(C)C 1P007JSP [0,1,0,0,0,0|2,1,0]=4 936 B11R1.87 Oc1cccnc1S(=O)(=O)N 1P00B7WA [0,1,0,0,0,0|2,0,1]=4 937 B11R1.87 Oc1ccncc1S(=O)(=O)O 1P003M0I [0,1,0,0,0,0|2,0,0]=3 938 B11R1.87 Oc1cnccc1C(O)(C)C 1P028I6E [0,1,0,0,0,0|2,0,1]=4 939 B11R1.87 Oc1ncccc1S(=O)(=O)Cl 1P01B3YZ [0,1,0,0,0,0|2,0,1]=4 940 B11R1.87 Oc1ncccc1S(=O)(=O)F 1P0292AZ [0,1,0,0,0,0|2,0,1]=4 941 B11R1.87 Oc1ncccc1S(=O)(=O)N 1P01B3YY [0,1,0,0,0,0|2,0,1]=4 942 B11R1.87 Sc1ccccc1S(=O)(=O)C 1P01AJKG [0,1,0,0,0,0|1,1,1]=4 943 B11R1.156 CC(=O)c1c(Br)cccc1Br 1P028AUP [0,1,0,0,0,0|2,0,0]=3 944 B11R1.156 CC(=O)c1c(Br)ccnc1F 1P027XPG [0,1,0,0,0,0|3,0,0]=4 945 B11R1.156 CC(=O)c1c(Br)cncc1Br 1P00IESC [0,1,0,0,0,0|3,0,0]=4 946 B11R1.156 CC(=O)c1c(C)cccc1C 1P00I4LM [0,1,0,0,0,0|2,0,0]=3 947 B11R1.156 CC(=O)c1c(C)cccc1F 1P0015D6 [0,1,0,0,0,0|2,0,0]=3 948 B11R1.156 CC(=O)c1c(C)cccc1N 1P00CLH2 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.156 CC(=O)c1c(C)cccc1O 1P00CN54 [0,1,0,0,0,0|1,0,0]=2 950 B11R1.156 CC(=O)c1c(C)cncc1Cl 1P009Y04 [0,1,0,0,0,0|3,0,0]=4 951 B11R1.156 CC(=O)c1c(Cl)cccc1Br 1P000S75 [0,1,0,0,0,0|2,0,0]=3 952 B11R1.156 CC(=O)c1c(Cl)cccc1Cl 1P0029P7 [0,1,0,0,0,0|2,0,0]=3 953 B11R1.156 CC(=O)c1c(Cl)ccnc1Br 1P01KKP2 [0,1,0,0,0,0|3,0,0]=4 954 B11R1.156 CC(=O)c1c(Cl)ccnc1Cl 1P000MYH [0,1,0,0,0,0|3,0,0]=4 955 B11R1.156 CC(=O)c1c(Cl)cncc1Cl 1P0039T6 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.156 CC(=O)c1c(F)cccc1Br 1P003780 [0,1,0,0,0,0|2,0,0]=3 957 B11R1.156 CC(=O)c1c(F)cccc1Cl 1P0032Z0 [0,1,0,0,0,0|2,0,0]=3 958 B11R1.156 CC(=O)c1c(F)cccc1F 1P0012PF [0,1,0,0,0,0|2,0,0]=3 959 B11R1.156 CC(=O)c1c(F)ccnc1Cl 1P028THW [0,1,0,0,0,0|3,0,0]=4 960 B11R1.156 CC(=O)c1c(F)ccnc1F 1P028NU3 [0,1,0,0,0,0|3,0,0]=4 961 B11R1.156 CC(=O)c1c(F)cncc1Br 1P000VI3 [0,1,0,0,0,0|3,0,0]=4 962 B11R1.156 CC(=O)c1c(N)cccc1Br 1P00IAFF [0,1,0,0,0,0|2,0,0]=3 963 B11R1.156 CC(=O)c1c(N)cccc1Cl 1P002KG8 [0,1,0,0,0,0|2,0,0]=3 964 B11R1.156 CC(=O)c1c(N)cccc1F 1P00IERD [0,1,0,0,0,0|2,0,0]=3 965 B11R1.156 CC(=O)c1c(N)ccnc1Cl 1P01K20E [0,1,0,0,0,0|3,0,0]=4 966 B11R1.156 CC(=O)c1c(O)cccc1Br 1P00DIC5 [0,1,0,0,0,0|1,0,0]=2 967 B11R1.156 CC(=O)c1c(O)cccc1Cl 1P003AA6 [0,1,0,0,0,0|1,0,0]=2 968 B11R1.156 CC(=O)c1c(O)cccc1F 1P003HRI [0,1,0,0,0,0|1,0,0]=2 969 B11R1.156 CC(=O)c1c(O)cccc1O 1P0033IE [0,1,0,0,0,0|1,0,0]=2 970 B11R1.156 CC(c1c(C)cccc1C)O 1P00AUIL [0,1,0,0,0,0|2,0,1]=4 971 B11R1.156 CC(c1c(Cl)cccc1Cl)O 1P003D9S [0,1,0,0,0,0|2,0,1]=4 972 B11R1.156 CC(c1c(F)cccc1Br)O 1P000KOQ [0,1,0,0,0,0|2,0,1]=4 973 B11R1.156 CC(c1c(F)cccc1Cl)O 1P019TX8 [0,1,0,0,0,0|2,0,1]=4 974 B11R1.156 CC(c1c(F)cccc1F)O 1P003D9T [0,1,0,0,0,0|2,0,1]=4 975 B11R1.156 CC(c1c(O)cccc1F)C 1P009YK2 [0,1,0,0,0,0|2,0,1]=4 976 B11R1.156 CC(c1c(O)cccc1F)N 1P028ZF1 [0,1,0,0,0,0|2,0,1]=4 977 B11R1.156 CS(=O)c1c(N)cccc1Cl 1P019U0M [0,1,0,0,0,0|3,0,0]=4 978 B11R1.156 C[C@@H](c1c(F)cccc1F)O 1P019YL4 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.156 C[C@H](c1c(F)cccc1Cl)O 1P01KL09 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.156 C[C@H](c1c(F)cccc1F)O 1P019X9S [0,1,0,0,0,0|2,0,1]=4 981 B11R1.156 ClC(=O)c1c(C)cccc1C 1P006Z60 [0,1,0,0,0,0|2,0,0]=3 982 B11R1.156 ClC(=O)c1c(C)cccc1Cl 1P003HHJ [0,1,0,0,0,0|2,0,0]=3 983 B11R1.156 ClC(=O)c1c(C)cccc1F 1P00D9F9 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.156 ClC(=O)c1c(Cl)cccc1Cl 1P003GK0 [0,1,0,0,0,0|2,0,0]=3 985 B11R1.156 ClC(=O)c1c(Cl)cncc1Cl 1P01EN80 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.156 ClC(=O)c1c(Cl)cncc1Cl 1P028J9H [0,1,0,0,0,0|3,0,0]=4 987 B11R1.156 ClC(=O)c1c(F)cccc1Br 1P0006ZV [0,1,0,0,0,0|2,0,0]=3 988 B11R1.156 ClC(=O)c1c(F)cccc1Cl 1P003HH1 [0,1,0,0,0,0|2,0,0]=3 989 B11R1.156 ClC(=O)c1c(F)cccc1F 1P0022NB [0,1,0,0,0,0|2,0,0]=3 990 B11R1.156 ClC(=O)c1c(F)cccc1I 1P003HRL [0,1,0,0,0,0|2,0,0]=3 991 B11R1.156 NC(=N)c1c(C)cccc1C 1P0281IT [0,1,0,0,0,0|3,0,0]=4 992 B11R1.156 NC(=N)c1c(F)cccc1Br 1P028TVT [0,1,0,0,0,0|3,0,0]=4 993 B11R1.156 NC(=N)c1c(F)cccc1Cl 1P000E5S [0,1,0,0,0,0|3,0,0]=4 994 B11R1.156 NC(=N)c1c(F)cccc1F 1P005FC2 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.156 NC(=N)c1c(O)cccc1Cl 1P01B274 [0,1,0,0,0,0|2,0,0]=3 996 B11R1.156 NC(=N)c1c(O)cccc1F 1P01BD9Z [0,1,0,0,0,0|2,0,0]=3 997 B11R1.156 NC(=O)c1c(Br)ccnc1F 1P027YBR [0,1,0,0,0,0|3,0,0]=4 998 B11R1.156 NC(=O)c1c(C)cc[nH]c1=O 1P01A5RB [0,1,0,0,0,0|2,0,1]=4 999 B11R1.156 NC(=O)c1c(C)cccc1C 1P00D8N6 [0,1,0,0,0,0|2,0,0]=3 1000 B11R1.156 NC(=O)c1c(C)cccc1Cl 1P000458 [0,1,0,0,0,0|2,0,0]=3 1001 B11R1.156 NC(=O)c1c(C)cccc1F 1P00IFRN [0,1,0,0,0,0|2,0,0]=3 1002 B11R1.156 NC(=O)c1c(C)cccc1N 1P002HEE [0,1,0,0,0,0|2,0,0]=3 1003 B11R1.156 NC(=O)c1c(C)ccnc1Cl 1P003HE5 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.156 NC(=O)c1c(C)cncc1C 1P008POF [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.156 NC(=O)c1c(Cl)cccc1Br 1P00FHEO [0,1,0,0,0,0|2,0,0]=3 1006 B11R1.156 NC(=O)c1c(Cl)cccc1Cl 1P002DHS [0,1,0,0,0,0|2,0,0]=3 1007 B11R1.156 NC(=O)c1c(Cl)cccc1I 1P000SEQ [0,1,0,0,0,0|2,0,0]=3 1008 B11R1.156 NC(=O)c1c(Cl)ccnc1Cl 1P00FGPQ [0,1,0,0,0,0|3,0,0]=4 1009 B11R1.156 NC(=O)c1c(F)cccc1Br 1P008UA4 [0,1,0,0,0,0|2,0,0]=3 1010 B11R1.156 NC(=O)c1c(F)cccc1Cl 1P00FAE1 [0,1,0,0,0,0|2,0,0]=3 1011 B11R1.156 NC(=O)c1c(F)cccc1F 1P0022NA [0,1,0,0,0,0|2,0,0]=3 1012 B11R1.156 NC(=O)c1c(F)cncc1Br 1P009ZCR [0,1,0,0,0,0|3,0,0]=4 1013 B11R1.156 NC(=O)c1c(N)cccc1Cl 1P00DJS8 [0,1,0,0,0,0|2,0,0]=3 1014 B11R1.156 NC(=O)c1c(N)cccc1F 1P000H5E [0,1,0,0,0,0|2,0,0]=3 1015 B11R1.156 NC(=O)c1c(N)ccnc1Cl 1P01BAWX [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.156 NC(=O)c1c(N)cncc1Br 1P01BJJ9 [0,1,0,0,0,0|3,0,0]=4 1017 B11R1.156 NC(=O)c1c(O)cccc1F 1P001VQH [0,1,0,0,0,0|1,0,0]=2 1018 B11R1.156 NC(=S)c1c(C)cccc1C 1P01DWXF [0,1,0,0,0,0|2,1,0]=4 1019 B11R1.156 NC(=S)c1c(Cl)cccc1Cl 1P002FY2 [0,1,0,0,0,0|2,1,0]=4 1020 B11R1.156 NC(=S)c1c(F)cccc1Cl 1P00M2YM [0,1,0,0,0,0|2,1,0]=4 1021 B11R1.156 NC(=S)c1c(F)cccc1F 1P00IB4S [0,1,0,0,0,0|2,1,0]=4 1022 B11R1.156 O=N(=O)c1c(C)cccc1O 1P00I9AV [0,1,0,0,0,0|1,0,1]=3 1023 B11R1.156 OB(c1c(Br)cccc1Br)O 1P003GJ7 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.156 OB(c1c(C)cccc1C)O 1P00029U [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.156 OB(c1c(C)cccc1Cl)O 1P00GB29 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.156 OB(c1c(C)cccc1F)O 1P004DTK [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.156 OB(c1c(Cl)cccc1Br)O 1P003C2L [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.156 OB(c1c(Cl)cccc1Cl)O 1P003GKF [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.156 OB(c1c(F)cccc1Br)O 1P00IH3H [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.156 OB(c1c(F)cccc1Cl)O 1P00C0SX [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.156 OB(c1c(F)cccc1F)O 1P001T7E [0,1,0,0,0,0|2,0,1]=4 1032 B11R1.156 OB(c1c(F)cccc1I)O 1P003HRM [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.156 OB(c1c(O)cccc1Cl)O 1P005XF5 [0,1,0,0,0,0|1,0,1]=3 1034 B11R1.156 OB(c1c(O)cccc1F)O 1P000OGT [0,1,0,0,0,0|1,0,1]=3 1035 B11R1.156 OB(c1c(O)cccc1O)O 1P004NKP [0,1,0,0,0,0|1,0,1]=3 1036 B11R1.156 OC(=O)c1c(Br)cccc1Br 1P0033HO [0,1,0,0,0,0|1,0,0]=2 1037 B11R1.156 OC(=O)c1c(Br)cccc1I 1P0007EI [0,1,0,0,0,0|1,0,0]=2 1038 B11R1.156 OC(=O)c1c(Br)ccnc1Br 1P000TYN [0,1,0,0,0,0|2,0,0]=3 1039 B11R1.156 OC(=O)c1c(Br)ccnc1Cl 1P008Y1J [0,1,0,0,0,0|2,0,0]=3 1040 B11R1.156 OC(=O)c1c(Br)ccnc1F 1P009YSQ [0,1,0,0,0,0|2,0,0]=3 1041 B11R1.156 OC(=O)c1c(Br)cncc1Br 1P001BRN [0,1,0,0,0,0|2,0,0]=3 1042 B11R1.156 OC(=O)c1c(C)cccc1Br 1P00GRQG [0,1,0,0,0,0|1,0,0]=2 1043 B11R1.156 OC(=O)c1c(C)cccc1C 1P003GM9 [0,1,0,0,0,0|1,0,0]=2 1044 B11R1.156 OC(=O)c1c(C)cccc1Cl 1P003HHH [0,1,0,0,0,0|1,0,0]=2 1045 B11R1.156 OC(=O)c1c(C)cccc1F 1P0033S6 [0,1,0,0,0,0|1,0,0]=2 1046 B11R1.156 OC(=O)c1c(C)cccc1I 1P00D95D [0,1,0,0,0,0|1,0,0]=2 1047 B11R1.156 OC(=O)c1c(C)cccc1N 1P003GZC [0,1,0,0,0,0|1,0,0]=2 1048 B11R1.156 OC(=O)c1c(C)cccc1O 1P003HVP [0,1,0,0,0,0|0,0,0]=1 1049 B11R1.156 OC(=O)c1c(C)ccnc1Br 1P00FHU2 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.156 OC(=O)c1c(C)ccnc1C 1P00D8TI [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.156 OC(=O)c1c(C)ccnc1C 1P00HTJL [0,1,0,0,0,0|2,0,0]=3 1052 B11R1.156 OC(=O)c1c(C)ccnc1Cl 1P001IJO [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.156 OC(=O)c1c(C)ccnc1N 1P00C7KB [0,1,0,0,0,0|2,0,0]=3 1054 B11R1.156 OC(=O)c1c(C)ccnc1N 1P01BU67 [0,1,0,0,0,0|2,0,0]=3 1055 B11R1.156 OC(=O)c1c(C)ccnc1O 1P00CHZT [0,1,0,0,0,0|1,0,0]=2 1056 B11R1.156 OC(=O)c1c(C)cncc1C 1P00DGRK [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.156 OC(=O)c1c(C)cncc1C 1P028OWN [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.156 OC(=O)c1c(C)cncc1F 1P01XCU5 [0,1,0,0,0,0|2,0,0]=3 1059 B11R1.156 OC(=O)c1c(C)ncnc1C 1P001PV0 [0,1,0,0,0,0|3,0,0]=4 1060 B11R1.156 OC(=O)c1c(Cl)cccc1Br 1P00IHZ1 [0,1,0,0,0,0|1,0,0]=2 1061 B11R1.156 OC(=O)c1c(Cl)cccc1Cl 1P003GJY [0,1,0,0,0,0|1,0,0]=2 1062 B11R1.156 OC(=O)c1c(Cl)cccc1I 1P009GXS [0,1,0,0,0,0|1,0,0]=2 1063 B11R1.156 OC(=O)c1c(Cl)ccnc1Br 1P00HIVI [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.156 OC(=O)c1c(Cl)ccnc1C 1P006BHX [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.156 OC(=O)c1c(Cl)ccnc1C 1P02845H [0,1,0,0,0,0|2,0,0]=3 1066 B11R1.156 OC(=O)c1c(Cl)ccnc1Cl 1P002SW3 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.156 OC(=O)c1c(Cl)ccnc1F 1P019ZN7 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.156 OC(=O)c1c(Cl)ccnc1N 1P00EIVF [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.156 OC(=O)c1c(Cl)cncc1Br 1P01K5TY [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.156 OC(=O)c1c(Cl)cncc1Cl 1P001BRM [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.156 OC(=O)c1c(Cl)ncnc1Cl 1P0036S9 [0,1,0,0,0,0|3,0,0]=4 1072 B11R1.156 OC(=O)c1c(F)cccc1Br 1P003H7G [0,1,0,0,0,0|1,0,0]=2 1073 B11R1.156 OC(=O)c1c(F)cccc1Cl 1P0033PF [0,1,0,0,0,0|1,0,0]=2 1074 B11R1.156 OC(=O)c1c(F)cccc1F 1P0033I8 [0,1,0,0,0,0|1,0,0]=2 1075 B11R1.156 OC(=O)c1c(F)cccc1I 1P003HRK [0,1,0,0,0,0|1,0,0]=2 1076 B11R1.156 OC(=O)c1c(F)ccnc1Br 1P008XEN [0,1,0,0,0,0|2,0,0]=3 1077 B11R1.156 OC(=O)c1c(F)ccnc1Cl 1P0037AL [0,1,0,0,0,0|2,0,0]=3 1078 B11R1.156 OC(=O)c1c(F)ccnc1F 1P00GA7Q [0,1,0,0,0,0|2,0,0]=3 1079 B11R1.156 OC(=O)c1c(F)ccnc1O 1P00I0IO [0,1,0,0,0,0|1,0,0]=2 1080 B11R1.156 OC(=O)c1c(F)cncc1Br 1P00H9HB [0,1,0,0,0,0|2,0,0]=3 1081 B11R1.156 OC(=O)c1c(F)cncc1Cl 1P006W8V [0,1,0,0,0,0|2,0,0]=3 1082 B11R1.156 OC(=O)c1c(F)cncc1F 1P003401 [0,1,0,0,0,0|2,0,0]=3 1083 B11R1.156 OC(=O)c1c(F)cncc1I 1P02834M [0,1,0,0,0,0|2,0,0]=3 1084 B11R1.156 OC(=O)c1c(I)ccnc1Cl 1P00IA77 [0,1,0,0,0,0|2,0,0]=3 1085 B11R1.156 OC(=O)c1c(I)ccnc1F 1P0036IV [0,1,0,0,0,0|2,0,0]=3 1086 B11R1.156 OC(=O)c1c(N)cccc1Br 1P002JQA [0,1,0,0,0,0|1,0,0]=2 1087 B11R1.156 OC(=O)c1c(N)cccc1Cl 1P003GYS [0,1,0,0,0,0|1,0,0]=2 1088 B11R1.156 OC(=O)c1c(N)cccc1F 1P003GZ3 [0,1,0,0,0,0|1,0,0]=2 1089 B11R1.156 OC(=O)c1c(N)cccc1I 1P002JQ7 [0,1,0,0,0,0|1,0,0]=2 1090 B11R1.156 OC(=O)c1c(N)cccc1O 1P00EISP [0,1,0,0,0,0|0,0,0]=1 1091 B11R1.156 OC(=O)c1c(N)ccnc1Br 1P0095PJ [0,1,0,0,0,0|2,0,0]=3 1092 B11R1.156 OC(=O)c1c(N)ccnc1Cl 1P00068T [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.156 OC(=O)c1c(O)cccc1Br 1P003986 [0,1,0,0,0,0|0,0,0]=1 1094 B11R1.156 OC(=O)c1c(O)cccc1Cl 1P00393T [0,1,0,0,0,0|0,0,0]=1 1095 B11R1.156 OC(=O)c1c(O)cccc1F 1P0034TR [0,1,0,0,0,0|0,0,0]=1 1096 B11R1.156 OC(=O)c1c(O)cccc1I 1P01ADNT [0,1,0,0,0,0|0,0,0]=1 1097 B11R1.156 OC(=O)c1c(O)cccc1O 1P00300P [0,1,0,0,0,0|0,0,0]=1 1098 B11R1.156 OC(=O)c1c(O)ccnc1Br 1P000G98 [0,1,0,0,0,0|1,0,0]=2 1099 B11R1.156 OC(=O)c1c(O)ccnc1O 1P023PBW [0,1,0,0,0,0|1,0,0]=2 1100 B11R1.156 OC(=O)c1c(O)cncc1F 1P027TX2 [0,1,0,0,0,0|1,0,0]=2 1101 B11R1.156 [O-]C(=O)c1c(Cl)cccc1Cl 1P0001A5 [0,1,0,0,0,0|1,0,1]=3 1102 B11R1.156 [O-]C(=O)c1c(F)cccc1Cl 1P0018RB [0,1,0,0,0,0|1,0,1]=3 1103 B11R1.156 [O-]C(=O)c1c(F)cccc1F 1P00EC73 [0,1,0,0,0,0|1,0,1]=3 1104 B11R1.156 [O-]S(=O)c1c(C)cccc1C 1P01FL97 [0,1,0,0,0,0|2,0,1]=4 1105 B11R1.156 [O-][N+](=O)c1c(Br)cccc1Br 1P009GXK [0,1,0,0,0,0|2,0,1]=4 1106 B11R1.156 [O-][N+](=O)c1c(Br)cccc1I 1P009MDY [0,1,0,0,0,0|2,0,1]=4 1107 B11R1.156 [O-][N+](=O)c1c(C)cccc1Br 1P003EKZ [0,1,0,0,0,0|2,0,1]=4 1108 B11R1.156 [O-][N+](=O)c1c(C)cccc1Cl 1P003I8O [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.156 [O-][N+](=O)c1c(C)cccc1F 1P0039AM [0,1,0,0,0,0|2,0,1]=4 1110 B11R1.156 [O-][N+](=O)c1c(C)cccc1I 1P00DJ36 [0,1,0,0,0,0|2,0,1]=4 1111 B11R1.156 [O-][N+](=O)c1c(C)cccc1N 1P00IB41 [0,1,0,0,0,0|2,0,1]=4 1112 B11R1.156 [O-][N+](=O)c1c(Cl)cccc1Br 1P00EQR4 [0,1,0,0,0,0|2,0,1]=4 1113 B11R1.156 [O-][N+](=O)c1c(Cl)cccc1Cl 1P00IB42 [0,1,0,0,0,0|2,0,1]=4 1114 B11R1.156 [O-][N+](=O)c1c(Cl)cccc1I 1P00H2G2 [0,1,0,0,0,0|2,0,1]=4 1115 B11R1.156 [O-][N+](=O)c1c(F)cccc1Br 1P003EKV [0,1,0,0,0,0|2,0,1]=4 1116 B11R1.156 [O-][N+](=O)c1c(F)cccc1Cl 1P003HH5 [0,1,0,0,0,0|2,0,1]=4 1117 B11R1.156 [O-][N+](=O)c1c(F)cccc1F 1P002F5Q [0,1,0,0,0,0|2,0,1]=4 1118 B11R1.156 [O-][N+](=O)c1c(F)cccc1I 1P00H1GM [0,1,0,0,0,0|2,0,1]=4 1119 B11R1.156 [O-][N+](=O)c1c(N)cccc1Br 1P003JHF [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.156 [O-][N+](=O)c1c(N)cccc1Cl 1P0036GR [0,1,0,0,0,0|2,0,1]=4 1121 B11R1.156 [O-][N+](=O)c1c(N)cccc1F 1P003JW0 [0,1,0,0,0,0|2,0,1]=4 1122 B11R1.156 [O-][N+](=O)c1c(N)cccc1I 1P00ICP5 [0,1,0,0,0,0|2,0,1]=4 1123 B11R1.156 [O-][N+](=O)c1c(N)ccnc1O 1P0038U4 [0,1,0,0,0,0|2,0,1]=4 1124 B11R1.156 [O-][N+](=O)c1c(O)cccc1Br 1P003A6B [0,1,0,0,0,0|1,0,1]=3 1125 B11R1.156 [O-][N+](=O)c1c(O)cccc1Cl 1P00ACKA [0,1,0,0,0,0|1,0,1]=3 1126 B11R1.156 [O-][N+](=O)c1c(O)cccc1F 1P00C72F [0,1,0,0,0,0|1,0,1]=3 1127 B11R1.156 [O-][N+](=O)c1c(O)cccc1I 1P00GY92 [0,1,0,0,0,0|1,0,1]=3 1128 B11R1.156 [O-][N+](=O)c1c(O)cccc1O 1P0033VO [0,1,0,0,0,0|1,0,1]=3 1129 B11R1.156 [O-][N+](=O)c1c(O)ccnc1Cl 1P00EDKH [0,1,0,0,0,0|2,0,1]=4 1130 B11R1.156 [O-][N+](=O)c1c(O)ccnc1O 1P003G9O [0,1,0,0,0,0|2,0,1]=4 1131 B11R1.159 CC(=C)c1cccc(c1Cl)Cl 1P01OKTV [0,1,0,0,0,0|3,0,0]=4 1132 B11R1.159 CC(=C)c1cccc(c1N)Br 1P01B1MY [0,1,0,0,0,0|3,0,0]=4 1133 B11R1.159 CC(=C)c1cccc(c1N)Cl 1P01XCA2 [0,1,0,0,0,0|3,0,0]=4 1134 B11R1.159 CC(=O)c1cccc(c1Br)C 1P00IIM4 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1P00HZ61 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.159 CC(=O)c1cccc(c1Br)F 1P001T0Q [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.159 CC(=O)c1cccc(c1Br)O 1P01FRM3 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.159 CC(=O)c1cccc(c1C)Br 1P00E3BI [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.159 CC(=O)c1cccc(c1C)C 1P0036P4 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.159 CC(=O)c1cccc(c1C)Cl 1P01FFEK [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.159 CC(=O)c1cccc(c1C)I 1P01JKQ6 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.159 CC(=O)c1cccc(c1C)O 1P00FOJ5 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1P001T0N [0,1,0,0,0,0|2,0,0]=3 1144 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1P003BKI [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.159 CC(=O)c1cccc(c1Cl)F 1P001T0R [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.159 CC(=O)c1cccc(c1F)Br 1P001T0O [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.159 CC(=O)c1cccc(c1F)C 1P00IEL8 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.159 CC(=O)c1cccc(c1F)Cl 1P001T0P [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.159 CC(=O)c1cccc(c1F)F 1P002852 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.159 CC(=O)c1cccc(c1F)N 1P01DS75 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.159 CC(=O)c1cccc(c1F)O 1P0094QQ [0,1,0,0,0,0|2,0,0]=3 1152 B11R1.159 CC(=O)c1cccc(c1N)C 1P00DKM6 [0,1,0,0,0,0|2,0,0]=3 1153 B11R1.159 CC(=O)c1cccc(c1N)Cl 1P00EET9 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.159 CC(=O)c1cccc(c1N)F 1P00AFYS [0,1,0,0,0,0|2,0,0]=3 1155 B11R1.159 CC(=O)c1cccc(c1N)O 1P00I8Y2 [0,1,0,0,0,0|2,0,0]=3 1156 B11R1.159 CC(=O)c1cccc(c1O)Br 1P00287B [0,1,0,0,0,0|1,0,0]=2 1157 B11R1.159 CC(=O)c1cccc(c1O)C 1P0032Z6 [0,1,0,0,0,0|1,0,0]=2 1158 B11R1.159 CC(=O)c1cccc(c1O)Cl 1P0038IK [0,1,0,0,0,0|1,0,0]=2 1159 B11R1.159 CC(=O)c1cccc(c1O)F 1P003412 [0,1,0,0,0,0|1,0,0]=2 1160 B11R1.159 CC(=O)c1cccc(c1O)N 1P00ICL0 [0,1,0,0,0,0|1,0,0]=2 1161 B11R1.159 CC(=O)c1cccc(c1O)N 1P00IGF1 [0,1,0,0,0,0|1,0,0]=2 1162 B11R1.159 CC(=O)c1ccnc(c1C)Cl 1P01K15G [0,1,0,0,0,0|3,0,0]=4 1163 B11R1.159 CC(=O)c1ccnc(c1F)Cl 1P01DFJG [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.159 CC(=O)c1ccnc(c1N)Cl 1P00BY2K [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.159 CC(=O)c1nccc(c1C)Cl 1P01AFX7 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.159 CC(=O)c1nccc(c1F)Cl 1P01XCP3 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.159 CC(c1cccc(c1C)Cl)O 1P01ESMI [0,1,0,0,0,0|2,0,1]=4 1168 B11R1.159 CC(c1cccc(c1Cl)Cl)O 1P00DTDJ [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.159 CC(c1cccc(c1F)Br)O 1P0017BY [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.159 CC(c1cccc(c1F)Cl)O 1P01AFTO [0,1,0,0,0,0|2,0,1]=4 1171 B11R1.159 CC(c1cccc(c1F)F)O 1P000K49 [0,1,0,0,0,0|2,0,1]=4 1172 B11R1.159 CC(c1cccc(c1N)C)O 1P00AV7J [0,1,0,0,0,0|2,0,1]=4 1173 B11R1.159 CC(c1cccc(c1O)Br)C 1P01JKRC [0,1,0,0,0,0|2,0,1]=4 1174 B11R1.159 CC(c1cccc(c1O)O)C 1P00731L [0,1,0,0,0,0|2,0,1]=4 1175 B11R1.159 CS(=O)c1cccc(c1N)C 1P01AFWC [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.159 C[C@@H](c1cccc(c1F)Cl)O 1P01A3OG [0,1,0,0,0,0|2,0,1]=4 1177 B11R1.159 C[C@H](c1cccc(c1F)Cl)O 1P01A3OF [0,1,0,0,0,0|2,0,1]=4 1178 B11R1.159 C[C@H](c1cccc(c1F)F)O 1P028FIF [0,1,0,0,0,0|2,0,1]=4 1179 B11R1.159 ClC(=O)c1cccc(c1C)F 1P001Y92 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.159 ClC(=O)c1cccc(c1Cl)C 1P007PAN [0,1,0,0,0,0|2,0,0]=3 1181 B11R1.159 ClC(=O)c1cccc(c1Cl)Cl 1P002VSN [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.159 ClC(=O)c1cccc(c1Cl)F 1P00BLZY [0,1,0,0,0,0|2,0,0]=3 1183 B11R1.159 ClC(=O)c1cccc(c1F)F 1P002855 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.159 Cn1cncc(c1=O)C(=O)O 1P0077X1 [0,1,0,0,0,0|2,0,1]=4 1185 B11R1.159 NC(=N)c1cccc(c1Cl)Cl 1P00GPPY [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.159 NC(=O)c1cccc(c1Br)F 1P0011I7 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.159 NC(=O)c1cccc(c1C)Br 1P00H1U4 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.159 NC(=O)c1cccc(c1C)C 1P003G0Y [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.159 NC(=O)c1cccc(c1C)Cl 1P00I4CG [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.159 NC(=O)c1cccc(c1C)F 1P00GYLJ [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.159 NC(=O)c1cccc(c1C)N 1P007A39 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.159 NC(=O)c1cccc(c1Cl)Cl 1P003FY4 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.159 NC(=O)c1cccc(c1Cl)F 1P00FERR [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.159 NC(=O)c1cccc(c1F)Br 1P00H041 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.159 NC(=O)c1cccc(c1F)C 1P000293 [0,1,0,0,0,0|2,0,0]=3 1196 B11R1.159 NC(=O)c1cccc(c1F)Cl 1P003445 [0,1,0,0,0,0|2,0,0]=3 1197 B11R1.159 NC(=O)c1cccc(c1F)F 1P002853 [0,1,0,0,0,0|2,0,0]=3 1198 B11R1.159 NC(=O)c1cccc(c1F)N 1P01FPBJ [0,1,0,0,0,0|2,0,0]=3 1199 B11R1.159 NC(=O)c1cccc(c1F)O 1P0066YB [0,1,0,0,0,0|2,0,0]=3 1200 B11R1.159 NC(=O)c1cccc(c1I)C 1P01K0VL [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.159 NC(=O)c1cccc(c1I)F 1P01A273 [0,1,0,0,0,0|2,0,0]=3 1202 B11R1.159 NC(=O)c1cccc(c1N)Br 1P003A9G [0,1,0,0,0,0|2,0,0]=3 1203 B11R1.159 NC(=O)c1cccc(c1N)C 1P002HED [0,1,0,0,0,0|2,0,0]=3 1204 B11R1.159 NC(=O)c1cccc(c1N)Cl 1P00APWW [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.159 NC(=O)c1cccc(c1N)F 1P002GZ7 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.159 NC(=O)c1cccc(c1N)N 1P0038XL [0,1,0,0,0,0|2,0,0]=3 1207 B11R1.159 NC(=O)c1cccc(c1N)O 1P001UNZ [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.159 NC(=O)c1cccc(c1O)C 1P001CHL [0,1,0,0,0,0|1,0,0]=2 1209 B11R1.159 NC(=O)c1cccc(c1O)Cl 1P00OA7D [0,1,0,0,0,0|1,0,0]=2 1210 B11R1.159 NC(=O)c1cccc(c1O)F 1P0067G4 [0,1,0,0,0,0|1,0,0]=2 1211 B11R1.159 NC(=O)c1cccc(c1O)I 1P021Z7V [0,1,0,0,0,0|1,0,0]=2 1212 B11R1.159 NC(=O)c1cccn(c1=O)C 1P005GL8 [0,1,0,0,0,0|2,0,1]=4 1213 B11R1.159 NC(=O)c1ccnc(c1Br)Cl 1P01BKQ2 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.159 NC(=O)c1ccnc(c1F)Cl 1P01B7GA [0,1,0,0,0,0|3,0,0]=4 1215 B11R1.159 NC(=O)c1ccnc(c1N)Cl 1P007HBX [0,1,0,0,0,0|3,0,0]=4 1216 B11R1.159 NC(=O)c1nccc(c1Cl)Cl 1P00088S [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.159 NC(=S)c1cccc(c1Cl)Cl 1P003FYJ [0,1,0,0,0,0|2,1,0]=4 1218 B11R1.159 O=N(=O)c1cccc(c1Br)Br 1P00BGL3 [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.159 O=N(=O)c1cccc(c1Br)C 1P003H3X [0,1,0,0,0,0|2,0,1]=4 1220 B11R1.159 O=N(=O)c1cccc(c1C)Cl 1P0033PN [0,1,0,0,0,0|2,0,1]=4 1221 B11R1.159 O=N(=O)c1cccc(c1F)F 1P00FAWA [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.159 O=N(=O)c1cccc(c1N)Cl 1P0033PM [0,1,0,0,0,0|2,0,1]=4 1223 B11R1.159 O=N(=O)c1cccc(c1N)O 1P0033JR [0,1,0,0,0,0|2,0,1]=4 1224 B11R1.159 OB(c1cccc(c1Br)C)O 1P01JXCC [0,1,0,0,0,0|2,0,1]=4 1225 B11R1.159 OB(c1cccc(c1Br)F)O 1P00IMJ3 [0,1,0,0,0,0|2,0,1]=4 1226 B11R1.159 OB(c1cccc(c1Br)I)O 1P00ATM5 [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.159 OB(c1cccc(c1C)Br)O 1P00964X [0,1,0,0,0,0|2,0,1]=4 1228 B11R1.159 OB(c1cccc(c1C)C)O 1P0024W0 [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.159 OB(c1cccc(c1C)Cl)O 1P0036FT [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.159 OB(c1cccc(c1C)F)O 1P001UMU [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.159 OB(c1cccc(c1C)N)O 1P01FTPB [0,1,0,0,0,0|2,0,1]=4 1232 B11R1.159 OB(c1cccc(c1C)O)O 1P00IJ2A [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.159 OB(c1cccc(c1Cl)Br)O 1P007ETD [0,1,0,0,0,0|2,0,1]=4 1234 B11R1.159 OB(c1cccc(c1Cl)C)O 1P00GTU5 [0,1,0,0,0,0|2,0,1]=4 1235 B11R1.159 OB(c1cccc(c1Cl)Cl)O 1P001NLS [0,1,0,0,0,0|2,0,1]=4 1236 B11R1.159 OB(c1cccc(c1Cl)F)O 1P004L34 [0,1,0,0,0,0|2,0,1]=4 1237 B11R1.159 OB(c1cccc(c1Cl)O)O 1P008FI8 [0,1,0,0,0,0|2,0,1]=4 1238 B11R1.159 OB(c1cccc(c1F)Br)O 1P00C1ER [0,1,0,0,0,0|2,0,1]=4 1239 B11R1.159 OB(c1cccc(c1F)C)O 1P008OPP [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.159 OB(c1cccc(c1F)Cl)O 1P0036A0 [0,1,0,0,0,0|2,0,1]=4 1241 B11R1.159 OB(c1cccc(c1F)F)O 1P003FZB [0,1,0,0,0,0|2,0,1]=4 1242 B11R1.159 OB(c1cccc(c1F)I)O 1P0005GR [0,1,0,0,0,0|2,0,1]=4 1243 B11R1.159 OB(c1cccc(c1F)N)O 1P01XCXB [0,1,0,0,0,0|2,0,1]=4 1244 B11R1.159 OB(c1cccc(c1F)O)O 1P004V9P [0,1,0,0,0,0|2,0,1]=4 1245 B11R1.159 OB(c1cccc(c1O)Br)O 1P0042D5 [0,1,0,0,0,0|1,0,1]=3 1246 B11R1.159 OB(c1cccc(c1O)C)O 1P002RIG [0,1,0,0,0,0|1,0,1]=3 1247 B11R1.159 OB(c1cccc(c1O)Cl)O 1P005TME [0,1,0,0,0,0|1,0,1]=3 1248 B11R1.159 OB(c1cccc(c1O)F)O 1P002RIE [0,1,0,0,0,0|1,0,1]=3 1249 B11R1.159 OC(=O)C1=CC=CC([N+]1=O)Br 1P019F26 [0,1,0,0,0,0|1,0,2]=4 1250 B11R1.159 OC(=O)c1[nH]cnc(=O)c1F 1P01S7L6 [0,1,0,0,0,0|3,0,0]=4 1251 B11R1.159 OC(=O)c1cccc(=O)n1C 1P00EISO [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.159 OC(=O)c1cccc(=O)n1O 1P005VPT [0,1,0,0,0,0|1,0,0]=2 1253 B11R1.159 OC(=O)c1cccc(=S)n1O 1P01BBM7 [0,1,0,0,0,0|1,0,0]=2 1254 B11R1.159 OC(=O)c1cccc([n+]1[O-])Cl 1P01XCPA [0,1,0,0,0,0|1,0,1]=3 1255 B11R1.159 OC(=O)c1cccc(c1Br)Br 1P00EDN3 [0,1,0,0,0,0|1,0,0]=2 1256 B11R1.159 OC(=O)c1cccc(c1Br)C 1P003H3Q [0,1,0,0,0,0|1,0,0]=2 1257 B11R1.159 OC(=O)c1cccc(c1Br)Cl 1P00EDUQ [0,1,0,0,0,0|1,0,0]=2 1258 B11R1.159 OC(=O)c1cccc(c1Br)F 1P0011I8 [0,1,0,0,0,0|1,0,0]=2 1259 B11R1.159 OC(=O)c1cccc(c1Br)I 1P0053BH [0,1,0,0,0,0|1,0,0]=2 1260 B11R1.159 OC(=O)c1cccc(c1Br)N 1P001YTB [0,1,0,0,0,0|1,0,0]=2 1261 B11R1.159 OC(=O)c1cccc(c1Br)N 1P028XY5 [0,1,0,0,0,0|1,0,0]=2 1262 B11R1.159 OC(=O)c1cccc(c1Br)O 1P006FN6 [0,1,0,0,0,0|1,0,0]=2 1263 B11R1.159 OC(=O)c1cccc(c1C)Br 1P00342N [0,1,0,0,0,0|1,0,0]=2 1264 B11R1.159 OC(=O)c1cccc(c1C)Cl 1P003JNW [0,1,0,0,0,0|1,0,0]=2 1265 B11R1.159 OC(=O)c1cccc(c1C)F 1P003JVX [0,1,0,0,0,0|1,0,0]=2 1266 B11R1.159 OC(=O)c1cccc(c1C)I 1P0014WQ [0,1,0,0,0,0|1,0,0]=2 1267 B11R1.159 OC(=O)c1cccc(c1C)N 1P00I9SE [0,1,0,0,0,0|1,0,0]=2 1268 B11R1.159 OC(=O)c1cccc(c1C)O 1P00346U [0,1,0,0,0,0|1,0,0]=2 1269 B11R1.159 OC(=O)c1cccc(c1Cl)Br 1P003JGV [0,1,0,0,0,0|1,0,0]=2 1270 B11R1.159 OC(=O)c1cccc(c1Cl)C 1P003HCK [0,1,0,0,0,0|1,0,0]=2 1271 B11R1.159 OC(=O)c1cccc(c1Cl)Cl 1P0037VY [0,1,0,0,0,0|1,0,0]=2 1272 B11R1.159 OC(=O)c1cccc(c1Cl)F 1P003HC3 [0,1,0,0,0,0|1,0,0]=2 1273 B11R1.159 OC(=O)c1cccc(c1Cl)I 1P003ATQ [0,1,0,0,0,0|1,0,0]=2 1274 B11R1.159 OC(=O)c1cccc(c1Cl)N 1P007ULN [0,1,0,0,0,0|1,0,0]=2 1275 B11R1.159 OC(=O)c1cccc(c1Cl)O 1P00DBW5 [0,1,0,0,0,0|1,0,0]=2 1276 B11R1.159 OC(=O)c1cccc(c1F)Br 1P001T0S [0,1,0,0,0,0|1,0,0]=2 1277 B11R1.159 OC(=O)c1cccc(c1F)C 1P003HPI [0,1,0,0,0,0|1,0,0]=2 1278 B11R1.159 OC(=O)c1cccc(c1F)Cl 1P001T0T [0,1,0,0,0,0|1,0,0]=2 1279 B11R1.159 OC(=O)c1cccc(c1F)F 1P00I8YK [0,1,0,0,0,0|1,0,0]=2 1280 B11R1.159 OC(=O)c1cccc(c1F)I 1P00DA39 [0,1,0,0,0,0|1,0,0]=2 1281 B11R1.159 OC(=O)c1cccc(c1F)N 1P00GV3A [0,1,0,0,0,0|1,0,0]=2 1282 B11R1.159 OC(=O)c1cccc(c1F)O 1P003HPD [0,1,0,0,0,0|1,0,0]=2 1283 B11R1.159 OC(=O)c1cccc(c1I)Br 1P00DGHR [0,1,0,0,0,0|1,0,0]=2 1284 B11R1.159 OC(=O)c1cccc(c1I)C 1P003HX5 [0,1,0,0,0,0|1,0,0]=2 1285 B11R1.159 OC(=O)c1cccc(c1I)Cl 1P000KQ7 [0,1,0,0,0,0|1,0,0]=2 1286 B11R1.159 OC(=O)c1cccc(c1I)F 1P00C0NV [0,1,0,0,0,0|1,0,0]=2 1287 B11R1.159 OC(=O)c1cccc(c1I)O 1P01KZLS [0,1,0,0,0,0|1,0,0]=2 1288 B11R1.159 OC(=O)c1cccc(c1N)Br 1P002JQ8 [0,1,0,0,0,0|1,0,0]=2 1289 B11R1.159 OC(=O)c1cccc(c1N)C 1P003GUE [0,1,0,0,0,0|1,0,0]=2 1290 B11R1.159 OC(=O)c1cccc(c1N)Cl 1P003GU2 [0,1,0,0,0,0|1,0,0]=2 1291 B11R1.159 OC(=O)c1cccc(c1N)F 1P003GU8 [0,1,0,0,0,0|1,0,0]=2 1292 B11R1.159 OC(=O)c1cccc(c1N)I 1P002JQ5 [0,1,0,0,0,0|1,0,0]=2 1293 B11R1.159 OC(=O)c1cccc(c1N)N 1P01DWDE [0,1,0,0,0,0|1,0,0]=2 1294 B11R1.159 OC(=O)c1cccc(c1N)N 1P0287V1 [0,1,0,0,0,0|1,0,0]=2 1295 B11R1.159 OC(=O)c1cccc(c1N)O 1P0036K7 [0,1,0,0,0,0|1,0,0]=2 1296 B11R1.159 OC(=O)c1cccc(c1N)O 1P003K0W [0,1,0,0,0,0|1,0,0]=2 1297 B11R1.159 OC(=O)c1cccc(c1N)S 1P028A14 [0,1,0,0,0,0|1,0,0]=2 1298 B11R1.159 OC(=O)c1cccc(c1O)C 1P0036AP [0,1,0,0,0,0|0,0,0]=1 1299 B11R1.159 OC(=O)c1cccc(c1O)Cl 1P0024OW [0,1,0,0,0,0|0,0,0]=1 1300 B11R1.159 OC(=O)c1cccc(c1O)F 1P003JVR [0,1,0,0,0,0|0,0,0]=1 1301 B11R1.159 OC(=O)c1cccc(c1O)O 1P00300K [0,1,0,0,0,0|0,0,0]=1 1302 B11R1.159 OC(=O)c1cccc(c1S)F 1P02839B [0,1,0,0,0,0|0,1,0]=2 1303 B11R1.159 OC(=O)c1cccn(c1=O)C 1P001O2K [0,1,0,0,0,0|1,0,1]=3 1304 B11R1.159 OC(=O)c1cccn(c1=O)O 1P0028JB [0,1,0,0,0,0|1,0,1]=3 1305 B11R1.159 OC(=O)c1ccnc(c1Br)Br 1P0006R5 [0,1,0,0,0,0|2,0,0]=3 1306 B11R1.159 OC(=O)c1ccnc(c1Br)Cl 1P00A63T [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.159 OC(=O)c1ccnc(c1C)Br 1P009W63 [0,1,0,0,0,0|2,0,0]=3 1308 B11R1.159 OC(=O)c1ccnc(c1C)C 1P00DLCQ [0,1,0,0,0,0|2,0,0]=3 1309 B11R1.159 OC(=O)c1ccnc(c1C)C 1P01KKSB [0,1,0,0,0,0|2,0,0]=3 1310 B11R1.159 OC(=O)c1ccnc(c1C)Cl 1P003HCI [0,1,0,0,0,0|2,0,0]=3 1311 B11R1.159 OC(=O)c1ccnc(c1Cl)Br 1P0015ES [0,1,0,0,0,0|2,0,0]=3 1312 B11R1.159 OC(=O)c1ccnc(c1Cl)C 1P0290EM [0,1,0,0,0,0|2,0,0]=3 1313 B11R1.159 OC(=O)c1ccnc(c1Cl)F 1P005EC2 [0,1,0,0,0,0|2,0,0]=3 1314 B11R1.159 OC(=O)c1ccnc(c1Cl)N 1P028BQY [0,1,0,0,0,0|2,0,0]=3 1315 B11R1.159 OC(=O)c1ccnc(c1F)Br 1P003H3E [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.159 OC(=O)c1ccnc(c1F)Cl 1P003HC5 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.159 OC(=O)c1ccnc(c1F)F 1P0033EG [0,1,0,0,0,0|2,0,0]=3 1318 B11R1.159 OC(=O)c1ccnc(c1F)I 1P007JPI [0,1,0,0,0,0|2,0,0]=3 1319 B11R1.159 OC(=O)c1ccnc(c1F)N 1P01KKK3 [0,1,0,0,0,0|2,0,0]=3 1320 B11R1.159 OC(=O)c1ccnc(c1F)O 1P0288QB [0,1,0,0,0,0|2,0,0]=3 1321 B11R1.159 OC(=O)c1ccnc(c1I)Cl 1P01A3ON [0,1,0,0,0,0|2,0,0]=3 1322 B11R1.159 OC(=O)c1ccnc(c1I)F 1P0286DN [0,1,0,0,0,0|2,0,0]=3 1323 B11R1.159 OC(=O)c1ccnc(c1N)Br 1P009ZCO [0,1,0,0,0,0|2,0,0]=3 1324 B11R1.159 OC(=O)c1ccnc(c1N)C 1P000KBD [0,1,0,0,0,0|2,0,0]=3 1325 B11R1.159 OC(=O)c1ccnc(c1N)C 1P02903T [0,1,0,0,0,0|2,0,0]=3 1326 B11R1.159 OC(=O)c1ccnc(c1N)Cl 1P00EGNM [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.159 OC(=O)c1ccnc(c1N)F 1P01B228 [0,1,0,0,0,0|2,0,0]=3 1328 B11R1.159 OC(=O)c1ccnc(c1N)F 1P0284YF [0,1,0,0,0,0|2,0,0]=3 1329 B11R1.159 OC(=O)c1ccnc(c1N)N 1P01A2L4 [0,1,0,0,0,0|2,0,0]=3 1330 B11R1.159 OC(=O)c1ccnc(c1N)N 1P01A2UT [0,1,0,0,0,0|2,0,0]=3 1331 B11R1.159 OC(=O)c1ccnc(c1N)O 1P0297Q6 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.159 OC(=O)c1ccnc(c1O)Br 1P0293CP [0,1,0,0,0,0|1,0,0]=2 1333 B11R1.159 OC(=O)c1ccnc(c1O)C 1P028NJ0 [0,1,0,0,0,0|1,0,0]=2 1334 B11R1.159 OC(=O)c1ccnc(c1O)Cl 1P00AKRB [0,1,0,0,0,0|1,0,0]=2 1335 B11R1.159 OC(=O)c1ccnc(c1O)F 1P01K2RW [0,1,0,0,0,0|1,0,0]=2 1336 B11R1.159 OC(=O)c1ccnc(c1O)O 1P028DXF [0,1,0,0,0,0|1,0,0]=2 1337 B11R1.159 OC(=O)c1cncc(c1C)Br 1P00FFSJ [0,1,0,0,0,0|2,0,0]=3 1338 B11R1.159 OC(=O)c1cncc(c1C)C 1P028H0B [0,1,0,0,0,0|2,0,0]=3 1339 B11R1.159 OC(=O)c1cncc(c1C)Cl 1P01AFRS [0,1,0,0,0,0|2,0,0]=3 1340 B11R1.159 OC(=O)c1cncc(c1C)F 1P00AAEB [0,1,0,0,0,0|2,0,0]=3 1341 B11R1.159 OC(=O)c1cncc(c1C)N 1P018BOZ [0,1,0,0,0,0|2,0,0]=3 1342 B11R1.159 OC(=O)c1cncc(c1Cl)Br 1P000OU4 [0,1,0,0,0,0|2,0,0]=3 1343 B11R1.159 OC(=O)c1cncc(c1Cl)C 1P01A4PO [0,1,0,0,0,0|2,0,0]=3 1344 B11R1.159 OC(=O)c1cncc(c1Cl)Cl 1P00DCF0 [0,1,0,0,0,0|2,0,0]=3 1345 B11R1.159 OC(=O)c1cncc(c1Cl)F 1P00IEBW [0,1,0,0,0,0|2,0,0]=3 1346 B11R1.159 OC(=O)c1cncc(c1Cl)O 1P02923W [0,1,0,0,0,0|2,0,0]=3 1347 B11R1.159 OC(=O)c1cncc(c1I)Br 1P003N02 [0,1,0,0,0,0|2,0,0]=3 1348 B11R1.159 OC(=O)c1cncc(c1N)Br 1P0037KJ [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.159 OC(=O)c1cncc(c1N)Br 1P01FIWF [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.159 OC(=O)c1cncc(c1O)Br 1P0085RA [0,1,0,0,0,0|1,0,0]=2 1351 B11R1.159 OC(=O)c1cncc(c1O)C 1P01A3F1 [0,1,0,0,0,0|1,0,0]=2 1352 B11R1.159 OC(=O)c1cncc(c1O)Cl 1P01B26M [0,1,0,0,0,0|1,0,0]=2 1353 B11R1.159 OC(=O)c1cncc(c1O)F 1P01B22D [0,1,0,0,0,0|1,0,0]=2 1354 B11R1.159 OC(=O)c1cnnc(c1C)C 1P027ZL3 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.159 OC(=O)c1nc[nH]c(=O)c1Cl 1P00IH6T [0,1,0,0,0,0|3,0,0]=4 1356 B11R1.159 OC(=O)c1nccc(c1Br)Br 1P028T4T [0,1,0,0,0,0|2,0,0]=3 1357 B11R1.159 OC(=O)c1nccc(c1Br)C 1P0249AW [0,1,0,0,0,0|2,0,0]=3 1358 B11R1.159 OC(=O)c1nccc(c1C)Br 1P0074G7 [0,1,0,0,0,0|2,0,0]=3 1359 B11R1.159 OC(=O)c1nccc(c1C)Cl 1P002ZSZ [0,1,0,0,0,0|2,0,0]=3 1360 B11R1.159 OC(=O)c1nccc(c1C)Cl 1P028F7I [0,1,0,0,0,0|2,0,0]=3 1361 B11R1.159 OC(=O)c1nccc(c1C)N 1P028S2R [0,1,0,0,0,0|2,0,0]=3 1362 B11R1.159 OC(=O)c1nccc(c1C)O 1P027WF1 [0,1,0,0,0,0|2,0,0]=3 1363 B11R1.159 OC(=O)c1nccc(c1Cl)Cl 1P0033Z4 [0,1,0,0,0,0|2,0,0]=3 1364 B11R1.159 OC(=O)c1nccc(c1Cl)F 1P028S5G [0,1,0,0,0,0|2,0,0]=3 1365 B11R1.159 OC(=O)c1nccc(c1Cl)N 1P00583Q [0,1,0,0,0,0|2,0,0]=3 1366 B11R1.159 OC(=O)c1nccc(c1Cl)N 1P028PPW [0,1,0,0,0,0|2,0,0]=3 1367 B11R1.159 OC(=O)c1nccc(c1F)C 1P027ZEP [0,1,0,0,0,0|2,0,0]=3 1368 B11R1.159 OC(=O)c1nccc(c1F)Cl 1P01A4YO [0,1,0,0,0,0|2,0,0]=3 1369 B11R1.159 OC(=O)c1nccc(c1N)C 1P00E45O [0,1,0,0,0,0|2,0,0]=3 1370 B11R1.159 OC(=O)c1nccc(c1N)C 1P028AG0 [0,1,0,0,0,0|2,0,0]=3 1371 B11R1.159 OC(=O)c1nccc(c1O)Br 1P01BGOW [0,1,0,0,0,0|1,0,0]=2 1372 B11R1.159 OC(=O)c1nccc(c1O)Br 1P028QAY [0,1,0,0,0,0|1,0,0]=2 1373 B11R1.159 OC(=O)c1nccc(c1O)C 1P01B7CB [0,1,0,0,0,0|1,0,0]=2 1374 B11R1.159 OC(=O)c1nccc(c1O)C 1P01BSPE [0,1,0,0,0,0|1,0,0]=2 1375 B11R1.159 OC(=O)c1ncnc(c1Br)O 1P009I6B [0,1,0,0,0,0|3,0,0]=4 1376 B11R1.159 OC(=O)c1ncnc(c1C)C 1P00II1S [0,1,0,0,0,0|3,0,0]=4 1377 B11R1.159 OC(=O)c1ncnc(c1C)Cl 1P006GOE [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.159 OC(=O)c1ncnc(c1Cl)Cl 1P00IH6U [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.159 OC(=O)c1ncnc(c1Cl)N 1P006ABH [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.159 OC(=O)c1ncnc(c1F)Cl 1P01FJ57 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.159 OC(=O)c1ncnc(c1O)C 1P027Q0S [0,1,0,0,0,0|2,0,0]=3 1382 B11R1.159 OC(=O)c1ncnc(c1O)O 1P00DK9F [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.159 [O-]C(=O)c1cccc(c1F)Cl 1P024I0Q [0,1,0,0,0,0|1,0,1]=3 1384 B11R1.159 [O-]C(=O)c1cccc(c1F)F 1P00HZ29 [0,1,0,0,0,0|1,0,1]=3 1385 B11R1.159 [O-]C(=O)c1cccc(c1O)C 1P003K8M [0,1,0,0,0,0|0,0,1]=2 1386 B11R1.159 [O-]C(=O)c1cccc(c1O)C 1P00CJ8W [0,1,0,0,0,0|0,0,1]=2 1387 B11R1.159 [O-]S(=O)c1cccc(c1C)Br 1P01C8SO [0,1,0,0,0,0|2,0,1]=4 1388 B11R1.159 [O-]S(=O)c1cccc(c1C)C 1P01FLA7 [0,1,0,0,0,0|2,0,1]=4 1389 B11R1.159 [O-]S(=O)c1cccc(c1F)F 1P01FDFW [0,1,0,0,0,0|2,0,1]=4 1390 B11R1.159 [O-][N+](=O)c1cccc(c1Br)Cl 1P002FMB [0,1,0,0,0,0|2,0,1]=4 1391 B11R1.159 [O-][N+](=O)c1cccc(c1Br)F 1P00E95N [0,1,0,0,0,0|2,0,1]=4 1392 B11R1.159 [O-][N+](=O)c1cccc(c1Br)I 1P01FHQ5 [0,1,0,0,0,0|2,0,1]=4 1393 B11R1.159 [O-][N+](=O)c1cccc(c1Br)N 1P00CJAO [0,1,0,0,0,0|2,0,1]=4 1394 B11R1.159 [O-][N+](=O)c1cccc(c1Br)N 1P01ADN3 [0,1,0,0,0,0|2,0,1]=4 1395 B11R1.159 [O-][N+](=O)c1cccc(c1Br)O 1P0006HA [0,1,0,0,0,0|2,0,1]=4 1396 B11R1.159 [O-][N+](=O)c1cccc(c1C)Br 1P003H7S [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.159 [O-][N+](=O)c1cccc(c1C)F 1P0033S8 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.159 [O-][N+](=O)c1cccc(c1C)I 1P00738B [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.159 [O-][N+](=O)c1cccc(c1C)N 1P003I3A [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.159 [O-][N+](=O)c1cccc(c1C)O 1P003I3E [0,1,0,0,0,0|2,0,1]=4 1401 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)Br 1P0036JO [0,1,0,0,0,0|2,0,1]=4 1402 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)C 1P00BY41 [0,1,0,0,0,0|2,0,1]=4 1403 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)Cl 1P00331D [0,1,0,0,0,0|2,0,1]=4 1404 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)F 1P00BCDY [0,1,0,0,0,0|2,0,1]=4 1405 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)I 1P01WZTG [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)N 1P00C71I [0,1,0,0,0,0|2,0,1]=4 1407 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)N 1P01B9H0 [0,1,0,0,0,0|2,0,1]=4 1408 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)O 1P003HCP [0,1,0,0,0,0|2,0,1]=4 1409 B11R1.159 [O-][N+](=O)c1cccc(c1Cl)S 1P0290MD [0,1,0,0,0,0|2,0,1]=4 1410 B11R1.159 [O-][N+](=O)c1cccc(c1F)Br 1P0037NK [0,1,0,0,0,0|2,0,1]=4 1411 B11R1.159 [O-][N+](=O)c1cccc(c1F)C 1P003HPN [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.159 [O-][N+](=O)c1cccc(c1F)Cl 1P002LCV [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.159 [O-][N+](=O)c1cccc(c1F)I 1P00HJL8 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.159 [O-][N+](=O)c1cccc(c1F)N 1P00BGLB [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.159 [O-][N+](=O)c1cccc(c1F)O 1P0027QZ [0,1,0,0,0,0|2,0,1]=4 1416 B11R1.159 [O-][N+](=O)c1cccc(c1I)Br 1P00C7O5 [0,1,0,0,0,0|2,0,1]=4 1417 B11R1.159 [O-][N+](=O)c1cccc(c1I)C 1P003HX2 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.159 [O-][N+](=O)c1cccc(c1I)Cl 1P00337A [0,1,0,0,0,0|2,0,1]=4 1419 B11R1.159 [O-][N+](=O)c1cccc(c1I)F 1P0017Q7 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.159 [O-][N+](=O)c1cccc(c1I)O 1P002B4P [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.159 [O-][N+](=O)c1cccc(c1N)Br 1P00EAYV [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.159 [O-][N+](=O)c1cccc(c1N)C 1P003I4P [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.159 [O-][N+](=O)c1cccc(c1N)F 1P00267X [0,1,0,0,0,0|2,0,1]=4 1424 B11R1.159 [O-][N+](=O)c1cccc(c1N)N 1P003DU1 [0,1,0,0,0,0|2,0,1]=4 1425 B11R1.159 [O-][N+](=O)c1cccc(c1O)Br 1P000VD5 [0,1,0,0,0,0|1,0,1]=3 1426 B11R1.159 [O-][N+](=O)c1cccc(c1O)C 1P000VD1 [0,1,0,0,0,0|1,0,1]=3 1427 B11R1.159 [O-][N+](=O)c1cccc(c1O)Cl 1P00EB38 [0,1,0,0,0,0|1,0,1]=3 1428 B11R1.159 [O-][N+](=O)c1cccc(c1O)F 1P003HRX [0,1,0,0,0,0|1,0,1]=3 1429 B11R1.159 [O-][N+](=O)c1cccc(c1O)I 1P000VD4 [0,1,0,0,0,0|1,0,1]=3 1430 B11R1.159 [O-][N+](=O)c1cccc(c1O)N 1P0037KA [0,1,0,0,0,0|1,0,1]=3 1431 B11R1.159 [O-][N+](=O)c1cccc(c1O)O 1P00FCNR [0,1,0,0,0,0|1,0,1]=3 1432 B11R1.159 [O-][N+](=O)c1ccnc(c1O)C 1P00IMRH [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.159 [O-][N+](=O)c1ccnc(c1O)Cl 1P001NOU [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.159 [O-][N+](=O)c1cncc(c1O)Br 1P003JIM [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.159 [O-][N+](=O)c1cncc(c1O)Cl 1P00CAU6 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.159 [O-][N+](=O)c1cncc(c1O)I 1P008STT [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.159 [O-][N+](=O)c1nccc(c1O)Br 1P01JWN5 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.159 [O-][N+](=O)c1nccc(c1O)C 1P001NOS [0,1,0,0,0,0|2,0,1]=4 1439 B11R1.166 Brc1ccc(c(c1)Br)C(=O)C 1P007H6P [0,1,0,0,0,0|2,0,0]=3 1440 B11R1.166 Brc1ccc(c(c1)Br)C(=O)N 1P00IF2D [0,1,0,0,0,0|2,0,0]=3 1441 B11R1.166 Brc1ccc(c(c1)Br)C(=O)O 1P003G6H [0,1,0,0,0,0|1,0,0]=2 1442 B11R1.166 Brc1ccc(c(c1)Br)[N+](=O)[O-] 1P003G6J [0,1,0,0,0,0|2,0,1]=4 1443 B11R1.166 Brc1ccc(c(c1)C)B(O)O 1P00BETN [0,1,0,0,0,0|2,0,1]=4 1444 B11R1.166 Brc1ccc(c(c1)C)C(=N)N 1P000E9Y [0,1,0,0,0,0|3,0,0]=4 1445 B11R1.166 Brc1ccc(c(c1)C)C(=O)C 1P00ED87 [0,1,0,0,0,0|2,0,0]=3 1446 B11R1.166 Brc1ccc(c(c1)C)C(=O)O 1P0034EB [0,1,0,0,0,0|1,0,0]=2 1447 B11R1.166 Brc1ccc(c(c1)C)C(O)C 1P0280F8 [0,1,0,0,0,0|2,0,1]=4 1448 B11R1.166 Brc1ccc(c(c1)C)[N+](=O)[O-] 1P003MYJ [0,1,0,0,0,0|2,0,1]=4 1449 B11R1.166 Brc1ccc(c(c1)Cl)B(O)O 1P007H5A [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)C 1P0036LO [0,1,0,0,0,0|2,0,0]=3 1451 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)Cl 1P01FF80 [0,1,0,0,0,0|2,0,0]=3 1452 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)N 1P00CKFQ [0,1,0,0,0,0|2,0,0]=3 1453 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)O 1P003LCY [0,1,0,0,0,0|1,0,0]=2 1454 B11R1.166 Brc1ccc(c(c1)Cl)[N+](=O)[O-] 1P01FSWZ [0,1,0,0,0,0|2,0,1]=4 1455 B11R1.166 Brc1ccc(c(c1)F)B(O)O 1P0038N2 [0,1,0,0,0,0|2,0,1]=4 1456 B11R1.166 Brc1ccc(c(c1)F)C(=N)N 1P008TUV [0,1,0,0,0,0|3,0,0]=4 1457 B11R1.166 Brc1ccc(c(c1)F)C(=O)C 1P00EBSE [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.166 Brc1ccc(c(c1)F)C(=O)Cl 1P003LDF [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.166 Brc1ccc(c(c1)F)C(=O)N 1P002YC5 [0,1,0,0,0,0|2,0,0]=3 1460 B11R1.166 Brc1ccc(c(c1)F)C(=O)O 1P0034E2 [0,1,0,0,0,0|1,0,0]=2 1461 B11R1.166 Brc1ccc(c(c1)F)C(O)C 1P00CNJK [0,1,0,0,0,0|2,0,1]=4 1462 B11R1.166 Brc1ccc(c(c1)F)[C@@H](O)C 1P01BC2S [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.166 Brc1ccc(c(c1)F)[C@H](O)C 1P01BC2R [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.166 Brc1ccc(c(c1)F)[N+](=O)[O-] 1P003HPZ [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.166 Brc1ccc(c(c1)I)C(=O)N 1P028RJB [0,1,0,0,0,0|2,0,0]=3 1466 B11R1.166 Brc1ccc(c(c1)I)C(=O)O 1P008TCP [0,1,0,0,0,0|1,0,0]=2 1467 B11R1.166 Brc1ccc(c(c1)I)[N+](=O)[O-] 1P00CI80 [0,1,0,0,0,0|2,0,1]=4 1468 B11R1.166 Brc1ccc(c(c1)N)C(=O)C 1P000LN2 [0,1,0,0,0,0|2,0,0]=3 1469 B11R1.166 Brc1ccc(c(c1)N)C(=O)N 1P0039FS [0,1,0,0,0,0|2,0,0]=3 1470 B11R1.166 Brc1ccc(c(c1)N)C(=O)O 1P002JQ9 [0,1,0,0,0,0|1,0,0]=2 1471 B11R1.166 Brc1ccc(c(c1)N)[N+](=O)[O-] 1P0034OH [0,1,0,0,0,0|2,0,1]=4 1472 B11R1.166 Brc1ccc(c(c1)O)C(=O)C 1P0034E4 [0,1,0,0,0,0|1,0,0]=2 1473 B11R1.166 Brc1ccc(c(c1)O)C(=O)N 1P00DHBZ [0,1,0,0,0,0|1,0,0]=2 1474 B11R1.166 Brc1ccc(c(c1)O)C(=O)O 1P001XB8 [0,1,0,0,0,0|0,0,0]=1 1475 B11R1.166 Brc1ccc(c(c1)O)C(=S)N 1P02909X [0,1,0,0,0,0|1,1,0]=3 1476 B11R1.166 Brc1ccc(c(c1)O)C(C)C 1P01DZ0S [0,1,0,0,0,0|2,0,1]=4 1477 B11R1.166 Brc1ccc(c(c1)O)[C@@H](N)C 1P024G15 [0,1,0,0,0,0|2,0,1]=4 1478 B11R1.166 Brc1ccc(c(c1)O)[C@H](N)C 1P0290Q1 [0,1,0,0,0,0|2,0,1]=4 1479 B11R1.166 Brc1ccc(c(c1)O)[N+](=O)[O-] 1P002UWN [0,1,0,0,0,0|1,0,1]=3 1480 B11R1.166 Brc1ccc(c(c1)S)C(=O)O 1P000CEP [0,1,0,0,0,0|0,1,0]=2 1481 B11R1.166 Brc1cnc(c(c1)Br)C(=O)N 1P00IED5 [0,1,0,0,0,0|3,0,0]=4 1482 B11R1.166 Brc1cnc(c(c1)Br)C(=O)O 1P00EAZ5 [0,1,0,0,0,0|2,0,0]=3 1483 B11R1.166 Brc1cnc(c(c1)C)C(=O)C 1P009EO1 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.166 Brc1cnc(c(c1)C)C(=O)O 1P0034O1 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.166 Brc1cnc(c(c1)Cl)C(=O)C 1P009EVT [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.166 Brc1cnc(c(c1)Cl)C(=O)N 1P01FLZK [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.166 Brc1cnc(c(c1)Cl)C(=O)O 1P0078H3 [0,1,0,0,0,0|2,0,0]=3 1488 B11R1.166 Brc1cnc(c(c1)F)C(=O)C 1P000C2I [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.166 Brc1cnc(c(c1)F)C(=O)N 1P00FE8E [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.166 Brc1cnc(c(c1)F)C(=O)O 1P0037BM [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.166 Brc1cnc(c(c1)I)C(=O)O 1P028UCU [0,1,0,0,0,0|2,0,0]=3 1492 B11R1.166 Brc1cnc(c(c1)N)C(=O)N 1P00341U [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.166 Brc1cnc(c(c1)N)C(=O)O 1P00341S [0,1,0,0,0,0|2,0,0]=3 1494 B11R1.166 Brc1cnc(c(c1)N)C(=O)O 1P00HYG9 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.166 Brc1cnc(c(c1)O)C(=O)C 1P001BB0 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.166 Brc1cnc(c(c1)O)C(=O)O 1P000C3F [0,1,0,0,0,0|1,0,0]=2 1497 B11R1.166 Brc1cnc(c(c1)O)[N+](=O)[O-] 1P0034OI [0,1,0,0,0,0|2,0,1]=4 1498 B11R1.166 CC(=O)c1ccc(=O)[nH]c1C 1P00DDQN [0,1,0,0,0,0|3,0,0]=4 1499 B11R1.166 CC(=O)c1ccc(nc1Cl)Cl 1P003J9T [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.166 CC(=O)c1ccc(nc1Cl)N 1P023Z8I [0,1,0,0,0,0|3,0,0]=4 1501 B11R1.166 CC(=O)c1ccc(nc1F)Br 1P024DOV [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.166 CC(=O)c1ccc(nc1F)F 1P00635O [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.166 CC(=O)c1cnc(cc1Cl)Cl 1P00IFW3 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.166 CC(C1=C(O)C=C(Cl)N=C1)=O 1P01KXON [0,1,0,0,0,0|2,0,0]=3 1505 B11R1.166 Cc1cc(=O)c(c[nH]1)C(=O)O 1P00C6BP [0,1,0,0,0,0|1,0,1]=3 1506 B11R1.166 Cc1cc(=O)c(n[nH]1)C(=O)O 1P01A5L2 [0,1,0,0,0,0|2,0,1]=4 1507 B11R1.166 Cc1cc(Br)c(cn1)C(=O)O 1P0094E8 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.166 Cc1cc(Br)ncc1C(=O)C 1P023RBX [0,1,0,0,0,0|3,0,0]=4 1509 B11R1.166 Cc1cc(Br)ncc1C(=O)N 1P01KKLQ [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.166 Cc1cc(Br)ncc1C(=O)O 1P00958U [0,1,0,0,0,0|2,0,0]=3 1511 B11R1.166 Cc1cc(C)ncc1C(=O)O 1P00BG4O [0,1,0,0,0,0|2,0,0]=3 1512 B11R1.166 Cc1cc(C)ncc1C(=O)O 1P00J3XG [0,1,0,0,0,0|2,0,0]=3 1513 B11R1.166 Cc1cc(Cl)c(cn1)C(=O)O 1P007WDK [0,1,0,0,0,0|2,0,0]=3 1514 B11R1.166 Cc1cc(Cl)ncc1C(=O)N 1P01JX6Q [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.166 Cc1cc(Cl)ncc1C(=O)O 1P00DCLY [0,1,0,0,0,0|2,0,0]=3 1516 B11R1.166 Cc1cc(Cl)ncc1S(=O)O 1P01FJ1M [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.166 Cc1cc(F)c(cn1)C(=O)O 1P0095UP [0,1,0,0,0,0|2,0,0]=3 1518 B11R1.166 Cc1cc(F)ncc1C(=O)O 1P00IIND [0,1,0,0,0,0|2,0,0]=3 1519 B11R1.166 Cc1cc(N)c(cn1)C(=O)O 1P000Y1A [0,1,0,0,0,0|2,0,0]=3 1520 B11R1.166 Cc1cc(N)ncc1C(=O)O 1P0027KG [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.166 Cc1cc(O)c(cn1)C(=O)O 1P003LZC [0,1,0,0,0,0|1,0,0]=2 1522 B11R1.166 Cc1ccc(c(c1)Br)B(O)O 1P01KYLG [0,1,0,0,0,0|2,0,1]=4 1523 B11R1.166 Cc1ccc(c(c1)Br)C(=O)C 1P00972K [0,1,0,0,0,0|2,0,0]=3 1524 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O 1P003H59 [0,1,0,0,0,0|1,0,0]=2 1525 B11R1.166 Cc1ccc(c(c1)Br)C(=S)N 1P01BSO0 [0,1,0,0,0,0|2,1,0]=4 1526 B11R1.166 Cc1ccc(c(c1)Br)[N+](=O)[O-] 1P0073M2 [0,1,0,0,0,0|2,0,1]=4 1527 B11R1.166 Cc1ccc(c(c1)C)B(O)O 1P003GBB [0,1,0,0,0,0|2,0,1]=4 1528 B11R1.166 Cc1ccc(c(c1)C)C(=O)C 1P0033GD [0,1,0,0,0,0|2,0,0]=3 1529 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl 1P003GB2 [0,1,0,0,0,0|2,0,0]=3 1530 B11R1.166 Cc1ccc(c(c1)C)C(=O)N 1P00FJLO [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.166 Cc1ccc(c(c1)C)C(=O)O 1P003GB0 [0,1,0,0,0,0|1,0,0]=2 1532 B11R1.166 Cc1ccc(c(c1)C)C(=S)N 1P00EVKO [0,1,0,0,0,0|2,1,0]=4 1533 B11R1.166 Cc1ccc(c(c1)C)[C@@H](O)C 1P00AV42 [0,1,0,0,0,0|2,0,1]=4 1534 B11R1.166 Cc1ccc(c(c1)C)[C@H](O)C 1P00AV0J [0,1,0,0,0,0|2,0,1]=4 1535 B11R1.166 Cc1ccc(c(c1)C)[N+](=O)[O-] 1P00IKV6 [0,1,0,0,0,0|2,0,1]=4 1536 B11R1.166 Cc1ccc(c(c1)Cl)B(O)O 1P001LAD [0,1,0,0,0,0|2,0,1]=4 1537 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)C 1P00IGPH [0,1,0,0,0,0|2,0,0]=3 1538 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)Cl 1P01EUZU [0,1,0,0,0,0|2,0,0]=3 1539 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O 1P00373P [0,1,0,0,0,0|1,0,0]=2 1540 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] 1P00I864 [0,1,0,0,0,0|2,0,1]=4 1541 B11R1.166 Cc1ccc(c(c1)F)B(O)O 1P003HQA [0,1,0,0,0,0|2,0,1]=4 1542 B11R1.166 Cc1ccc(c(c1)F)C(=N)N 1P02855S [0,1,0,0,0,0|3,0,0]=4 1543 B11R1.166 Cc1ccc(c(c1)F)C(=N)N 1P028A8Q [0,1,0,0,0,0|3,0,0]=4 1544 B11R1.166 Cc1ccc(c(c1)F)C(=O)C 1P002YTP [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.166 Cc1ccc(c(c1)F)C(=O)N 1P00GYLH [0,1,0,0,0,0|2,0,0]=3 1546 B11R1.166 Cc1ccc(c(c1)F)C(=O)O 1P0033RT [0,1,0,0,0,0|1,0,0]=2 1547 B11R1.166 Cc1ccc(c(c1)F)C(=O)[O-] 1P01K5DP [0,1,0,0,0,0|1,0,1]=3 1548 B11R1.166 Cc1ccc(c(c1)F)C(=S)N 1P01BUFV [0,1,0,0,0,0|2,1,0]=4 1549 B11R1.166 Cc1ccc(c(c1)F)N(=O)=O 1P003462 [0,1,0,0,0,0|2,0,1]=4 1550 B11R1.166 Cc1ccc(c(c1)F)S(=O)[O-] 1P01C8MR [0,1,0,0,0,0|2,0,1]=4 1551 B11R1.166 Cc1ccc(c(c1)I)C(=O)O 1P0024P0 [0,1,0,0,0,0|1,0,0]=2 1552 B11R1.166 Cc1ccc(c(c1)I)[N+](=O)[O-] 1P003HX7 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.166 Cc1ccc(c(c1)N)C(=O)C 1P000JHK [0,1,0,0,0,0|2,0,0]=3 1554 B11R1.166 Cc1ccc(c(c1)N)C(=O)N 1P0037RM [0,1,0,0,0,0|2,0,0]=3 1555 B11R1.166 Cc1ccc(c(c1)N)C(=O)O 1P002MH6 [0,1,0,0,0,0|1,0,0]=2 1556 B11R1.166 Cc1ccc(c(c1)N)[N+](=O)[O-] 1P00EAIM [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.166 Cc1ccc(c(c1)O)B(O)O 1P002RID [0,1,0,0,0,0|1,0,1]=3 1558 B11R1.166 Cc1ccc(c(c1)O)C(=O)C 1P00ICDM [0,1,0,0,0,0|1,0,0]=2 1559 B11R1.166 Cc1ccc(c(c1)O)C(=O)N 1P00I9C0 [0,1,0,0,0,0|1,0,0]=2 1560 B11R1.166 Cc1ccc(c(c1)O)C(=O)O 1P0034KS [0,1,0,0,0,0|0,0,0]=1 1561 B11R1.166 Cc1ccc(c(c1)O)C(C)C 1P0036Q9 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.166 Cc1ccc(c(c1)O)[N+](=O)[O-] 1P003NBY [0,1,0,0,0,0|1,0,1]=3 1563 B11R1.166 Cc1ccc(c(n1)Br)C(=O)O 1P0092W9 [0,1,0,0,0,0|2,0,0]=3 1564 B11R1.166 Cc1ccc(c(n1)C)C(=O)C 1P00AENJ [0,1,0,0,0,0|3,0,0]=4 1565 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)N 1P00DIZD [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O 1P0030WD [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.166 Cc1ccc(c(n1)N)C(=O)C 1P01WJXR [0,1,0,0,0,0|3,0,0]=4 1568 B11R1.166 Cc1ccc(c(n1)N)C(=O)N 1P009SAB [0,1,0,0,0,0|3,0,0]=4 1569 B11R1.166 Cc1ccc(c(n1)N)C(=O)O 1P004QR8 [0,1,0,0,0,0|2,0,0]=3 1570 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 1P02865F [0,1,0,0,0,0|2,0,0]=3 1571 B11R1.166 Cc1ccc(c(n1)O)C(=O)O 1P003HVQ [0,1,0,0,0,0|1,0,0]=2 1572 B11R1.166 Cc1cnc(c(c1)Br)C(=O)C 1P028ZMO [0,1,0,0,0,0|3,0,0]=4 1573 B11R1.166 Cc1cnc(c(c1)Br)C(=O)O 1P0074GB [0,1,0,0,0,0|2,0,0]=3 1574 B11R1.166 Cc1cnc(c(c1)C)C(=O)O 1P00DCM0 [0,1,0,0,0,0|2,0,0]=3 1575 B11R1.166 Cc1cnc(c(c1)C)C(=O)O 1P01EKM3 [0,1,0,0,0,0|2,0,0]=3 1576 B11R1.166 Cc1cnc(c(c1)F)C(=O)O 1P000OUE [0,1,0,0,0,0|2,0,0]=3 1577 B11R1.166 Cc1cnc(c(c1)N)C(=O)N 1P0097FN [0,1,0,0,0,0|3,0,0]=4 1578 B11R1.166 Cc1cnc(c(c1)N)C(=O)O 1P00E45P [0,1,0,0,0,0|2,0,0]=3 1579 B11R1.166 Cc1cnc(c(c1)O)C(=O)O 1P00G237 [0,1,0,0,0,0|1,0,0]=2 1580 B11R1.166 Cc1cnc(c(c1)O)C(=O)O 1P01AC8F [0,1,0,0,0,0|1,0,0]=2 1581 B11R1.166 Cc1cnc(c(n1)N)C(=O)O 1P005ZDF [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.166 Cc1nc(Br)ccc1C(=O)O 1P0090B6 [0,1,0,0,0,0|2,0,0]=3 1583 B11R1.166 Cc1nc(C)ccc1C(=O)O 1P0092VF [0,1,0,0,0,0|2,0,0]=3 1584 B11R1.166 Cc1nc(C)ccc1C(=O)O 1P00EAEW [0,1,0,0,0,0|2,0,0]=3 1585 B11R1.166 Cc1nc(C)cnc1C(=O)O 1P00IIVO [0,1,0,0,0,0|3,0,0]=4 1586 B11R1.166 Cc1nc(Cl)ccc1C(=O)O 1P0013BC [0,1,0,0,0,0|2,0,0]=3 1587 B11R1.166 Cc1nc(F)ccc1C(=O)O 1P004F2X [0,1,0,0,0,0|2,0,0]=3 1588 B11R1.166 Cc1nc(N)cnc1C(=O)O 1P028XUJ [0,1,0,0,0,0|3,0,0]=4 1589 B11R1.166 Cc1ncc(c(=O)[nH]1)C(=O)O 1P007U1O [0,1,0,0,0,0|2,0,1]=4 1590 B11R1.166 Cc1ncc(c(c1)C)C(=O)C 1P00HBIZ [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.166 Cc1ncc(c(c1)N)C(=O)C 1P000Y1B [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.166 Cc1ncc(c(c1)O)C(=O)C 1P028ECN [0,1,0,0,0,0|2,0,0]=3 1593 B11R1.166 Cc1ncc(c(n1)Br)C(=O)O 1P01DW02 [0,1,0,0,0,0|3,0,0]=4 1594 B11R1.166 Cc1ncc(c(n1)C)C(=O)O 1P0033GG [0,1,0,0,0,0|3,0,0]=4 1595 B11R1.166 Cc1ncc(c(n1)N)C(=O)O 1P005868 [0,1,0,0,0,0|3,0,0]=4 1596 B11R1.166 Clc1ccc(c(c1)Br)B(O)O 1P01DMPY [0,1,0,0,0,0|2,0,1]=4 1597 B11R1.166 Clc1ccc(c(c1)Br)C(=O)C 1P008JB4 [0,1,0,0,0,0|2,0,0]=3 1598 B11R1.166 Clc1ccc(c(c1)Br)C(=O)N 1P000VSA [0,1,0,0,0,0|2,0,0]=3 1599 B11R1.166 Clc1ccc(c(c1)Br)C(=O)O 1P003H4M [0,1,0,0,0,0|1,0,0]=2 1600 B11R1.166 Clc1ccc(c(c1)Br)[N+](=O)[O-] 1P0037FR [0,1,0,0,0,0|2,0,1]=4 1601 B11R1.166 Clc1ccc(c(c1)C)B(O)O 1P0036J4 [0,1,0,0,0,0|2,0,1]=4 1602 B11R1.166 Clc1ccc(c(c1)C)C(=O)C 1P00I7SA [0,1,0,0,0,0|2,0,0]=3 1603 B11R1.166 Clc1ccc(c(c1)C)C(=O)N 1P0094FZ [0,1,0,0,0,0|2,0,0]=3 1604 B11R1.166 Clc1ccc(c(c1)C)C(=O)O 1P003LKH [0,1,0,0,0,0|1,0,0]=2 1605 B11R1.166 Clc1ccc(c(c1)C)C(=O)[O-] 1P01K5CT [0,1,0,0,0,0|1,0,1]=3 1606 B11R1.166 Clc1ccc(c(c1)C)[N+](=O)[O-] 1P003N4D [0,1,0,0,0,0|2,0,1]=4 1607 B11R1.166 Clc1ccc(c(c1)Cl)B(O)O 1P0033FW [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.166 Clc1ccc(c(c1)Cl)C(=C)C 1P020IMY [0,1,0,0,0,0|3,0,0]=4 1609 B11R1.166 Clc1ccc(c(c1)Cl)C(=N)N 1P007XYF [0,1,0,0,0,0|3,0,0]=4 1610 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)C 1P003G7N [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)Cl 1P003G7T [0,1,0,0,0,0|2,0,0]=3 1612 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)N 1P002OPH [0,1,0,0,0,0|2,0,0]=3 1613 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)O 1P003G7R [0,1,0,0,0,0|1,0,0]=2 1614 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)[O-] 1P00CTXR [0,1,0,0,0,0|1,0,1]=3 1615 B11R1.166 Clc1ccc(c(c1)Cl)C(=S)N 1P002V4C [0,1,0,0,0,0|2,1,0]=4 1616 B11R1.166 Clc1ccc(c(c1)Cl)C(O)C 1P001FER [0,1,0,0,0,0|2,0,1]=4 1617 B11R1.166 Clc1ccc(c(c1)Cl)S(=O)[O-] 1P01ANB1 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.166 Clc1ccc(c(c1)Cl)[C@@H](O)C 1P00AQ90 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.166 Clc1ccc(c(c1)Cl)[C@H](O)C 1P019X6A [0,1,0,0,0,0|2,0,1]=4 1620 B11R1.166 Clc1ccc(c(c1)Cl)[N+](=O)[O-] 1P00IB9P [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.166 Clc1ccc(c(c1)F)B(O)O 1P001SIR [0,1,0,0,0,0|2,0,1]=4 1622 B11R1.166 Clc1ccc(c(c1)F)C(=O)C 1P0021L4 [0,1,0,0,0,0|2,0,0]=3 1623 B11R1.166 Clc1ccc(c(c1)F)C(=O)N 1P008XPO [0,1,0,0,0,0|2,0,0]=3 1624 B11R1.166 Clc1ccc(c(c1)F)C(=O)O 1P003LJS [0,1,0,0,0,0|1,0,0]=2 1625 B11R1.166 Clc1ccc(c(c1)F)[N+](=O)[O-] 1P003LJW [0,1,0,0,0,0|2,0,1]=4 1626 B11R1.166 Clc1ccc(c(c1)I)C(=O)C 1P02491R [0,1,0,0,0,0|2,0,0]=3 1627 B11R1.166 Clc1ccc(c(c1)I)C(=O)O 1P003LK4 [0,1,0,0,0,0|1,0,0]=2 1628 B11R1.166 Clc1ccc(c(c1)I)[N+](=O)[O-] 1P001VYZ [0,1,0,0,0,0|2,0,1]=4 1629 B11R1.166 Clc1ccc(c(c1)N)C(=O)C 1P00CJA1 [0,1,0,0,0,0|2,0,0]=3 1630 B11R1.166 Clc1ccc(c(c1)N)C(=O)N 1P003GVO [0,1,0,0,0,0|2,0,0]=3 1631 B11R1.166 Clc1ccc(c(c1)N)C(=O)O 1P0033JX [0,1,0,0,0,0|1,0,0]=2 1632 B11R1.166 Clc1ccc(c(c1)N)[N+](=O)[O-] 1P001UML [0,1,0,0,0,0|2,0,1]=4 1633 B11R1.166 Clc1ccc(c(c1)O)B(O)O 1P000LKU [0,1,0,0,0,0|1,0,1]=3 1634 B11R1.166 Clc1ccc(c(c1)O)C(=N)N 1P01B28A [0,1,0,0,0,0|2,0,0]=3 1635 B11R1.166 Clc1ccc(c(c1)O)C(=O)C 1P0034FX [0,1,0,0,0,0|1,0,0]=2 1636 B11R1.166 Clc1ccc(c(c1)O)C(=O)N 1P00CRUM [0,1,0,0,0,0|1,0,0]=2 1637 B11R1.166 Clc1ccc(c(c1)O)C(=O)O 1P003LP6 [0,1,0,0,0,0|0,0,0]=1 1638 B11R1.166 Clc1ccc(c(c1)O)[C@@H](N)C 1P028XA6 [0,1,0,0,0,0|2,0,1]=4 1639 B11R1.166 Clc1ccc(c(c1)O)[N+](=O)[O-] 1P003N4B [0,1,0,0,0,0|1,0,1]=3 1640 B11R1.166 Clc1ccc(c(c1)S)C(=O)O 1P002984 [0,1,0,0,0,0|0,1,0]=2 1641 B11R1.166 Clc1cnc(c(c1)Br)C(=O)O 1P007RPB [0,1,0,0,0,0|2,0,0]=3 1642 B11R1.166 Clc1cnc(c(c1)C)C(=O)C 1P009ETO [0,1,0,0,0,0|3,0,0]=4 1643 B11R1.166 Clc1cnc(c(c1)C)C(=O)O 1P008AZG [0,1,0,0,0,0|2,0,0]=3 1644 B11R1.166 Clc1cnc(c(c1)Cl)C(=O)C 1P001GW6 [0,1,0,0,0,0|3,0,0]=4 1645 B11R1.166 Clc1cnc(c(c1)Cl)C(=O)N 1P00DIIO [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.166 Clc1cnc(c(c1)Cl)C(=O)O 1P0051PB [0,1,0,0,0,0|2,0,0]=3 1647 B11R1.166 Clc1cnc(c(c1)F)C(=O)C 1P000OWH [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.166 Clc1cnc(c(c1)F)C(=O)N 1P00BFS8 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.166 Clc1cnc(c(c1)F)C(=O)O 1P002JVA [0,1,0,0,0,0|2,0,0]=3 1650 B11R1.166 Clc1cnc(c(c1)N)C(=O)N 1P00BD2C [0,1,0,0,0,0|3,0,0]=4 1651 B11R1.166 Clc1cnc(c(c1)N)C(=O)O 1P00BJ6D [0,1,0,0,0,0|2,0,0]=3 1652 B11R1.166 Clc1cnc(c(c1)N)C(=O)O 1P00DGHQ [0,1,0,0,0,0|2,0,0]=3 1653 B11R1.166 Clc1cnc(c(c1)O)C(=O)O 1P01AG9C [0,1,0,0,0,0|1,0,0]=2 1654 B11R1.166 Clc1cnc(c(c1)O)[N+](=O)[O-] 1P00H1HN [0,1,0,0,0,0|2,0,1]=4 1655 B11R1.166 Clc1ncc(c(n1)C)C(=O)O 1P002HS4 [0,1,0,0,0,0|3,0,0]=4 1656 B11R1.166 Clc1ncc(c(n1)Cl)C(=O)O 1P0037SD [0,1,0,0,0,0|3,0,0]=4 1657 B11R1.166 Clc1ncc(c(n1)N)C(=O)O 1P008NRA [0,1,0,0,0,0|3,0,0]=4 1658 B11R1.166 Fc1ccc(c(c1)Br)B(O)O 1P001681 [0,1,0,0,0,0|2,0,1]=4 1659 B11R1.166 Fc1ccc(c(c1)Br)C(=O)C 1P0002WP [0,1,0,0,0,0|2,0,0]=3 1660 B11R1.166 Fc1ccc(c(c1)Br)C(=O)Cl 1P006NYK [0,1,0,0,0,0|2,0,0]=3 1661 B11R1.166 Fc1ccc(c(c1)Br)C(=O)N 1P0090J0 [0,1,0,0,0,0|2,0,0]=3 1662 B11R1.166 Fc1ccc(c(c1)Br)C(=O)O 1P0002WO [0,1,0,0,0,0|1,0,0]=2 1663 B11R1.166 Fc1ccc(c(c1)Br)[C@@H](O)C 1P027AOP [0,1,0,0,0,0|2,0,1]=4 1664 B11R1.166 Fc1ccc(c(c1)Br)[N+](=O)[O-] 1P003H4Z [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.166 Fc1ccc(c(c1)C)B(O)O 1P006WXR [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.166 Fc1ccc(c(c1)C)C(=O)C 1P003LTW [0,1,0,0,0,0|2,0,0]=3 1667 B11R1.166 Fc1ccc(c(c1)C)C(=O)Cl 1P006Z5Z [0,1,0,0,0,0|2,0,0]=3 1668 B11R1.166 Fc1ccc(c(c1)C)C(=O)N 1P00GYK9 [0,1,0,0,0,0|2,0,0]=3 1669 B11R1.166 Fc1ccc(c(c1)C)C(=O)O 1P003LWE [0,1,0,0,0,0|1,0,0]=2 1670 B11R1.166 Fc1ccc(c(c1)C)[C@@H](O)C 1P01BO7F [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.166 Fc1ccc(c(c1)C)[C@H](O)C 1P01BO7E [0,1,0,0,0,0|2,0,1]=4 1672 B11R1.166 Fc1ccc(c(c1)C)[N+](=O)[O-] 1P003N80 [0,1,0,0,0,0|2,0,1]=4 1673 B11R1.166 Fc1ccc(c(c1)Cl)B(O)O 1P00344S [0,1,0,0,0,0|2,0,1]=4 1674 B11R1.166 Fc1ccc(c(c1)Cl)C(=N)N 1P00EDSV [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)C 1P0033OH [0,1,0,0,0,0|2,0,0]=3 1676 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)Cl 1P006Z5Y [0,1,0,0,0,0|2,0,0]=3 1677 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)N 1P004BUA [0,1,0,0,0,0|2,0,0]=3 1678 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)O 1P0033OJ [0,1,0,0,0,0|1,0,0]=2 1679 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)[O-] 1P01BBOE [0,1,0,0,0,0|1,0,1]=3 1680 B11R1.166 Fc1ccc(c(c1)Cl)C(=S)N 1P0290PY [0,1,0,0,0,0|2,1,0]=4 1681 B11R1.166 Fc1ccc(c(c1)Cl)C(O)C 1P007CV4 [0,1,0,0,0,0|2,0,1]=4 1682 B11R1.166 Fc1ccc(c(c1)Cl)S(=O)[O-] 1P01BU4W [0,1,0,0,0,0|2,0,1]=4 1683 B11R1.166 Fc1ccc(c(c1)Cl)[C@@H](O)C 1P00GV21 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.166 Fc1ccc(c(c1)Cl)[C@H](O)C 1P01ABI7 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.166 Fc1ccc(c(c1)Cl)[N+](=O)[O-] 1P002LCU [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.166 Fc1ccc(c(c1)F)B(O)O 1P001J9N [0,1,0,0,0,0|2,0,1]=4 1687 B11R1.166 Fc1ccc(c(c1)F)C(=C)C 1P001PA0 [0,1,0,0,0,0|3,0,0]=4 1688 B11R1.166 Fc1ccc(c(c1)F)C(=N)N 1P00GW0D [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.166 Fc1ccc(c(c1)F)C(=O)C 1P003G91 [0,1,0,0,0,0|2,0,0]=3 1690 B11R1.166 Fc1ccc(c(c1)F)C(=O)Cl 1P0033G2 [0,1,0,0,0,0|2,0,0]=3 1691 B11R1.166 Fc1ccc(c(c1)F)C(=O)N 1P003G95 [0,1,0,0,0,0|2,0,0]=3 1692 B11R1.166 Fc1ccc(c(c1)F)C(=O)O 1P001QKH [0,1,0,0,0,0|1,0,0]=2 1693 B11R1.166 Fc1ccc(c(c1)F)C(=O)[O-] 1P00256O [0,1,0,0,0,0|1,0,1]=3 1694 B11R1.166 Fc1ccc(c(c1)F)C(=S)N 1P00218C [0,1,0,0,0,0|2,1,0]=4 1695 B11R1.166 Fc1ccc(c(c1)F)C(O)C 1P019NR1 [0,1,0,0,0,0|2,0,1]=4 1696 B11R1.166 Fc1ccc(c(c1)F)[C@@H](O)C 1P019Y9P [0,1,0,0,0,0|2,0,1]=4 1697 B11R1.166 Fc1ccc(c(c1)F)[C@H](O)C 1P019X9K [0,1,0,0,0,0|2,0,1]=4 1698 B11R1.166 Fc1ccc(c(c1)F)[N+](=O)[O-] 1P003G9E [0,1,0,0,0,0|2,0,1]=4 1699 B11R1.166 Fc1ccc(c(c1)I)C(=O)O 1P003LTS [0,1,0,0,0,0|1,0,0]=2 1700 B11R1.166 Fc1ccc(c(c1)I)[N+](=O)[O-] 1P0075GF [0,1,0,0,0,0|2,0,1]=4 1701 B11R1.166 Fc1ccc(c(c1)N)C(=O)C 1P001R2J [0,1,0,0,0,0|2,0,0]=3 1702 B11R1.166 Fc1ccc(c(c1)N)C(=O)C 1P01A7C3 [0,1,0,0,0,0|2,0,0]=3 1703 B11R1.166 Fc1ccc(c(c1)N)C(=O)N 1P000PJB [0,1,0,0,0,0|2,0,0]=3 1704 B11R1.166 Fc1ccc(c(c1)N)C(=O)O 1P003GVV [0,1,0,0,0,0|1,0,0]=2 1705 B11R1.166 Fc1ccc(c(c1)N)[N+](=O)[O-] 1P002OMY [0,1,0,0,0,0|2,0,1]=4 1706 B11R1.166 Fc1ccc(c(c1)O)B(O)O 1P004PSX [0,1,0,0,0,0|1,0,1]=3 1707 B11R1.166 Fc1ccc(c(c1)O)C(=O)C 1P001FX6 [0,1,0,0,0,0|1,0,0]=2 1708 B11R1.166 Fc1ccc(c(c1)O)C(=O)O 1P0034HO [0,1,0,0,0,0|0,0,0]=1 1709 B11R1.166 Fc1ccc(c(c1)O)N(C)C 1P0287YV [0,1,0,0,0,0|3,0,0]=4 1710 B11R1.166 Fc1ccc(c(c1)O)[N+](=O)[O-] 1P003N7Y [0,1,0,0,0,0|1,0,1]=3 1711 B11R1.166 Fc1ccc(c(c1)S)C(=O)O 1P004ZLZ [0,1,0,0,0,0|0,1,0]=2 1712 B11R1.166 Fc1cnc(c(c1)Br)C(=O)O 1P007RPA [0,1,0,0,0,0|2,0,0]=3 1713 B11R1.166 Fc1cnc(c(c1)C)C(=O)O 1P000OVN [0,1,0,0,0,0|2,0,0]=3 1714 B11R1.166 Fc1cnc(c(c1)C)C(=O)O 1P028H40 [0,1,0,0,0,0|2,0,0]=3 1715 B11R1.166 Fc1cnc(c(c1)Cl)C(=O)O 1P000Y80 [0,1,0,0,0,0|2,0,0]=3 1716 B11R1.166 Fc1cnc(c(c1)F)C(=O)C 1P0094JV [0,1,0,0,0,0|3,0,0]=4 1717 B11R1.166 Fc1cnc(c(c1)F)C(=O)O 1P0036ZH [0,1,0,0,0,0|2,0,0]=3 1718 B11R1.166 Fc1cnc(c(c1)N)C(=O)O 1P028E2S [0,1,0,0,0,0|2,0,0]=3 1719 B11R1.166 Fc1cnc(c(c1)O)C(=O)O 1P028V60 [0,1,0,0,0,0|1,0,0]=2 1720 B11R1.166 Fc1cnc(c(c1)O)[N+](=O)[O-] 1P00GAED [0,1,0,0,0,0|2,0,1]=4 1721 B11R1.166 Ic1ccc(c(c1)Br)C(=O)C 1P01JKTV [0,1,0,0,0,0|2,0,0]=3 1722 B11R1.166 Ic1ccc(c(c1)Br)C(=O)N 1P00HJFY [0,1,0,0,0,0|2,0,0]=3 1723 B11R1.166 Ic1ccc(c(c1)Br)C(=O)O 1P002W5V [0,1,0,0,0,0|1,0,0]=2 1724 B11R1.166 Ic1ccc(c(c1)Br)[N+](=O)[O-] 1P01FHQ6 [0,1,0,0,0,0|2,0,1]=4 1725 B11R1.166 Ic1ccc(c(c1)C)C(=O)O 1P0014WP [0,1,0,0,0,0|1,0,0]=2 1726 B11R1.166 Ic1ccc(c(c1)C)[N+](=O)[O-] 1P00DLKP [0,1,0,0,0,0|2,0,1]=4 1727 B11R1.166 Ic1ccc(c(c1)Cl)C(=O)O 1P001LAI [0,1,0,0,0,0|1,0,0]=2 1728 B11R1.166 Ic1ccc(c(c1)Cl)[N+](=O)[O-] 1P00IG31 [0,1,0,0,0,0|2,0,1]=4 1729 B11R1.166 Ic1ccc(c(c1)F)B(O)O 1P00I7UC [0,1,0,0,0,0|2,0,1]=4 1730 B11R1.166 Ic1ccc(c(c1)F)C(=O)O 1P000N3H [0,1,0,0,0,0|1,0,0]=2 1731 B11R1.166 Ic1ccc(c(c1)F)[N+](=O)[O-] 1P00385J [0,1,0,0,0,0|2,0,1]=4 1732 B11R1.166 Ic1ccc(c(c1)N)C(=O)O 1P002JQ6 [0,1,0,0,0,0|1,0,0]=2 1733 B11R1.166 Ic1ccc(c(c1)O)C(=O)O 1P001YPT [0,1,0,0,0,0|0,0,0]=1 1734 B11R1.166 Ic1ccc(c(c1)O)[N+](=O)[O-] 1P002V7A [0,1,0,0,0,0|1,0,1]=3 1735 B11R1.166 NC(=O)c1ccc(nc1Cl)Cl 1P00EG2B [0,1,0,0,0,0|3,0,0]=4 1736 B11R1.166 NC(=O)c1ccc(nc1O)O 1P003GLH [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.166 NC(=O)c1cnc(cc1Cl)Cl 1P005UCP [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.166 Nc1cc(Cl)c(cn1)C(=O)O 1P008YVH [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.166 Nc1cc(Cl)ncc1C(=O)N 1P02812G [0,1,0,0,0,0|3,0,0]=4 1740 B11R1.166 Nc1cc(Cl)ncc1C(=O)O 1P0097H1 [0,1,0,0,0,0|2,0,0]=3 1741 B11R1.166 Nc1cc(Cl)nnc1C(=O)O 1P01AA2A [0,1,0,0,0,0|3,0,0]=4 1742 B11R1.166 Nc1cc(F)c(cn1)C(=O)O 1P028LJ9 [0,1,0,0,0,0|2,0,0]=3 1743 B11R1.166 Nc1cc(F)ncc1C(=O)O 1P000M6R [0,1,0,0,0,0|2,0,0]=3 1744 B11R1.166 Nc1cc(N)ncc1C(=O)O 1P028J9G [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.166 Nc1ccc(c(c1)Br)C(=O)C 1P00HJFL [0,1,0,0,0,0|2,0,0]=3 1746 B11R1.166 Nc1ccc(c(c1)Br)C(=O)O 1P002Q53 [0,1,0,0,0,0|1,0,0]=2 1747 B11R1.166 Nc1ccc(c(c1)Br)C(=O)O 1P01DX04 [0,1,0,0,0,0|1,0,0]=2 1748 B11R1.166 Nc1ccc(c(c1)Br)[N+](=O)[O-] 1P00CASW [0,1,0,0,0,0|2,0,1]=4 1749 B11R1.166 Nc1ccc(c(c1)C)C(=O)C 1P00C7HZ [0,1,0,0,0,0|2,0,0]=3 1750 B11R1.166 Nc1ccc(c(c1)C)C(=O)N 1P00DNPM [0,1,0,0,0,0|2,0,0]=3 1751 B11R1.166 Nc1ccc(c(c1)C)C(=O)O 1P002Q4Y [0,1,0,0,0,0|1,0,0]=2 1752 B11R1.166 Nc1ccc(c(c1)C)[N+](=O)[O-] 1P00IB9O [0,1,0,0,0,0|2,0,1]=4 1753 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)C 1P005RMU [0,1,0,0,0,0|2,0,0]=3 1754 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)N 1P002LRN [0,1,0,0,0,0|2,0,0]=3 1755 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)O 1P002P2E [0,1,0,0,0,0|1,0,0]=2 1756 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)O 1P019WYV [0,1,0,0,0,0|1,0,0]=2 1757 B11R1.166 Nc1ccc(c(c1)Cl)[N+](=O)[O-] 1P008JB1 [0,1,0,0,0,0|2,0,1]=4 1758 B11R1.166 Nc1ccc(c(c1)F)C(=O)N 1P00ED7P [0,1,0,0,0,0|2,0,0]=3 1759 B11R1.166 Nc1ccc(c(c1)F)C(=O)O 1P003L58 [0,1,0,0,0,0|1,0,0]=2 1760 B11R1.166 Nc1ccc(c(c1)F)S(=O)C 1P019SHI [0,1,0,0,0,0|3,0,0]=4 1761 B11R1.166 Nc1ccc(c(c1)F)[N+](=O)[O-] 1P002OMW [0,1,0,0,0,0|2,0,1]=4 1762 B11R1.166 Nc1ccc(c(c1)I)C(=O)O 1P008QUX [0,1,0,0,0,0|1,0,0]=2 1763 B11R1.166 Nc1ccc(c(c1)I)[N+](=O)[O-] 1P01BEDF [0,1,0,0,0,0|2,0,1]=4 1764 B11R1.166 Nc1ccc(c(c1)N)C(=O)N 1P028RPQ [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.166 Nc1ccc(c(c1)N)C(=O)O 1P003G5Z [0,1,0,0,0,0|1,0,0]=2 1766 B11R1.166 Nc1ccc(c(c1)N)C(=O)O 1P00F3FM [0,1,0,0,0,0|1,0,0]=2 1767 B11R1.166 Nc1ccc(c(c1)N)[N+](=O)[O-] 1P002D49 [0,1,0,0,0,0|2,0,1]=4 1768 B11R1.166 Nc1ccc(c(c1)N)[N+](=O)[O-] 1P003MBQ [0,1,0,0,0,0|2,0,1]=4 1769 B11R1.166 Nc1ccc(c(c1)O)C(=O)C 1P002PTO [0,1,0,0,0,0|1,0,0]=2 1770 B11R1.166 Nc1ccc(c(c1)O)C(=O)N 1P00ENYU [0,1,0,0,0,0|1,0,0]=2 1771 B11R1.166 Nc1ccc(c(c1)O)C(=O)O 1P003L8T [0,1,0,0,0,0|0,0,0]=1 1772 B11R1.166 Nc1ccc(c(c1)O)C(=O)O 1P00737J [0,1,0,0,0,0|0,0,0]=1 1773 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P0011Y6 [0,1,0,0,0,0|0,0,1]=2 1774 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P0011Y7 [0,1,0,0,0,0|0,0,1]=2 1775 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P00IB4H [0,1,0,0,0,0|0,0,1]=2 1776 B11R1.166 Nc1ccc(c(c1)O)C(C)C 1P00GB5T [0,1,0,0,0,0|2,0,1]=4 1777 B11R1.166 Nc1ccc(c(c1)S)C(=O)O 1P005N76 [0,1,0,0,0,0|0,1,0]=2 1778 B11R1.166 Nc1ccc(c(n1)Br)C(=O)O 1P00L9S5 [0,1,0,0,0,0|2,0,0]=3 1779 B11R1.166 Nc1ccc(c(n1)Cl)C(=O)O 1P020N2W [0,1,0,0,0,0|2,0,0]=3 1780 B11R1.166 Nc1ccc(c(n1)F)C(=O)N 1P0021EC [0,1,0,0,0,0|3,0,0]=4 1781 B11R1.166 Nc1ccc(c(n1)F)C(=O)O 1P020KK9 [0,1,0,0,0,0|2,0,0]=3 1782 B11R1.166 Nc1cnc(c(c1)C)C(=O)O 1P028OUO [0,1,0,0,0,0|2,0,0]=3 1783 B11R1.166 Nc1cnc(c(c1)Cl)C(=O)O 1P0285EA [0,1,0,0,0,0|2,0,0]=3 1784 B11R1.166 Nc1nc(Br)ccc1C(=O)N 1P01XDA7 [0,1,0,0,0,0|3,0,0]=4 1785 B11R1.166 Nc1nc(Br)ccc1C(=O)O 1P000PTS [0,1,0,0,0,0|2,0,0]=3 1786 B11R1.166 Nc1nc(Cl)ccc1C(=O)N 1P003GYX [0,1,0,0,0,0|3,0,0]=4 1787 B11R1.166 Nc1nc(Cl)ccc1C(=O)O 1P00ECT0 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.166 Nc1nc(Cl)cnc1C(=O)O 1P000RGG [0,1,0,0,0,0|3,0,0]=4 1789 B11R1.166 Nc1ncc(c(=O)[nH]1)C(=O)O 1P00JBLX [0,1,0,0,0,0|2,0,1]=4 1790 B11R1.166 Nc1ncc(c(c1)C)C(=O)N 1P028WZT [0,1,0,0,0,0|3,0,0]=4 1791 B11R1.166 Nc1ncc(c(n1)C)C(=O)O 1P008OZ4 [0,1,0,0,0,0|3,0,0]=4 1792 B11R1.166 Nc1ncc(c(n1)Cl)C(=O)O 1P000LXY [0,1,0,0,0,0|3,0,0]=4 1793 B11R1.166 Nc1ncc(c(n1)N)C(=O)O 1P007T96 [0,1,0,0,0,0|3,0,0]=4 1794 B11R1.166 O=c1ccc(c(o1)C)C(=O)O 1P00BIFY [0,1,0,0,0,0|2,0,0]=3 1795 B11R1.166 OC(=C1C=CC(=O)NC1=O)O 1P008RLF [0,1,0,0,0,0|1,0,2]=4 1796 B11R1.166 OC(=O)c1c[nH]c(=O)[nH]c1=O 1P0033G9 [0,1,0,0,0,0|2,0,1]=4 1797 B11R1.166 OC(=O)c1c[nH]c(=O)cc1C 1P01E8WS [0,1,0,0,0,0|2,0,0]=3 1798 B11R1.166 OC(=O)c1c[nH]c(=O)cc1O 1P00DGGH [0,1,0,0,0,0|1,0,0]=2 1799 B11R1.166 OC(=O)c1c[nH]c(=S)[nH]c1=O 1P0036LH [0,1,0,0,0,0|2,0,1]=4 1800 B11R1.166 OC(=O)c1ccc(=O)[nH]c1Br 1P0284F5 [0,1,0,0,0,0|2,0,0]=3 1801 B11R1.166 OC(=O)c1ccc(=O)[nH]c1C 1P00FHPX [0,1,0,0,0,0|2,0,0]=3 1802 B11R1.166 OC(=O)c1ccc([nH]c1=O)Cl 1P00397W [0,1,0,0,0,0|1,0,1]=3 1803 B11R1.166 OC(=O)c1ccc(nc1Br)Br 1P00D8VK [0,1,0,0,0,0|2,0,0]=3 1804 B11R1.166 OC(=O)c1ccc(nc1Br)Cl 1P007ELE [0,1,0,0,0,0|2,0,0]=3 1805 B11R1.166 OC(=O)c1ccc(nc1Cl)Br 1P003NKF [0,1,0,0,0,0|2,0,0]=3 1806 B11R1.166 OC(=O)c1ccc(nc1Cl)Cl 1P003GK8 [0,1,0,0,0,0|2,0,0]=3 1807 B11R1.166 OC(=O)c1ccc(nc1Cl)F 1P007PLV [0,1,0,0,0,0|2,0,0]=3 1808 B11R1.166 OC(=O)c1ccc(nc1F)Br 1P0015B1 [0,1,0,0,0,0|2,0,0]=3 1809 B11R1.166 OC(=O)c1ccc(nc1F)Cl 1P009I3M [0,1,0,0,0,0|2,0,0]=3 1810 B11R1.166 OC(=O)c1ccc(nc1F)F 1P0038E0 [0,1,0,0,0,0|2,0,0]=3 1811 B11R1.166 OC(=O)c1cnc(=O)[nH]c1C 1P000UGR [0,1,0,0,0,0|3,0,0]=4 1812 B11R1.166 OC(=O)c1cnc(cc1Br)Br 1P008R5V [0,1,0,0,0,0|2,0,0]=3 1813 B11R1.166 OC(=O)c1cnc(cc1Br)Cl 1P000OX7 [0,1,0,0,0,0|2,0,0]=3 1814 B11R1.166 OC(=O)c1cnc(cc1Br)F 1P01R6L7 [0,1,0,0,0,0|2,0,0]=3 1815 B11R1.166 OC(=O)c1cnc(cc1Cl)Br 1P003AME [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.166 OC(=O)c1cnc(cc1Cl)Cl 1P003L02 [0,1,0,0,0,0|2,0,0]=3 1817 B11R1.166 OC(=O)c1cnc(cc1F)Br 1P0084VJ [0,1,0,0,0,0|2,0,0]=3 1818 B11R1.166 OC(=O)c1cnc(cc1F)F 1P0038V5 [0,1,0,0,0,0|2,0,0]=3 1819 B11R1.166 OC(=O)c1cnc(cc1I)Br 1P000QJ5 [0,1,0,0,0,0|2,0,0]=3 1820 B11R1.166 OC(=O)c1cnc(cc1I)Cl 1P00HGFR [0,1,0,0,0,0|2,0,0]=3 1821 B11R1.166 OC(=O)c1n[nH]c(=O)cc1C 1P01DX7M [0,1,0,0,0,0|3,0,0]=4 1822 B11R1.166 OC(=O)c1n[nH]c(=O)cc1O 1P001JMG [0,1,0,0,0,0|2,0,0]=3 1823 B11R1.166 OC(=O)c1ncc([nH]c1=O)Cl 1P01DFL5 [0,1,0,0,0,0|2,0,1]=4 1824 B11R1.166 OC(=O)c1ncc(nc1Cl)Cl 1P0039A1 [0,1,0,0,0,0|3,0,0]=4 1825 B11R1.166 OC(=O)c1nnc(cc1Cl)Cl 1P008UNR [0,1,0,0,0,0|3,0,0]=4 1826 B11R1.166 OS(=O)c1ccc(nc1F)Cl 1P028LZS [0,1,0,0,0,0|3,0,0]=4 1827 B11R1.166 Oc1ccc(c(c1)Br)C(=O)C 1P00EITL [0,1,0,0,0,0|2,0,0]=3 1828 B11R1.166 Oc1ccc(c(c1)Br)C(=O)O 1P00BK8U [0,1,0,0,0,0|1,0,0]=2 1829 B11R1.166 Oc1ccc(c(c1)Br)[N+](=O)[O-] 1P003JJ1 [0,1,0,0,0,0|2,0,1]=4 1830 B11R1.166 Oc1ccc(c(c1)C)B(O)O 1P00DEFP [0,1,0,0,0,0|2,0,1]=4 1831 B11R1.166 Oc1ccc(c(c1)C)C(=O)C 1P008FCZ [0,1,0,0,0,0|2,0,0]=3 1832 B11R1.166 Oc1ccc(c(c1)C)C(=O)N 1P01B6TP [0,1,0,0,0,0|2,0,0]=3 1833 B11R1.166 Oc1ccc(c(c1)C)C(=O)O 1P003LY6 [0,1,0,0,0,0|1,0,0]=2 1834 B11R1.166 Oc1ccc(c(c1)C)[N+](=O)[O-] 1P006WJT [0,1,0,0,0,0|2,0,1]=4 1835 B11R1.166 Oc1ccc(c(c1)Cl)B(O)O 1P005B0T [0,1,0,0,0,0|2,0,1]=4 1836 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)C 1P0036A8 [0,1,0,0,0,0|2,0,0]=3 1837 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)N 1P003HDZ [0,1,0,0,0,0|2,0,0]=3 1838 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)O 1P003HE0 [0,1,0,0,0,0|1,0,0]=2 1839 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)O 1P003HE1 [0,1,0,0,0,0|1,0,0]=2 1840 B11R1.166 Oc1ccc(c(c1)Cl)C(=S)N 1P028W6N [0,1,0,0,0,0|2,1,0]=4 1841 B11R1.166 Oc1ccc(c(c1)Cl)[N+](=O)[O-] 1P00396Q [0,1,0,0,0,0|2,0,1]=4 1842 B11R1.166 Oc1ccc(c(c1)F)B(O)O 1P007LVY [0,1,0,0,0,0|2,0,1]=4 1843 B11R1.166 Oc1ccc(c(c1)F)C(=O)C 1P0032QF [0,1,0,0,0,0|2,0,0]=3 1844 B11R1.166 Oc1ccc(c(c1)F)C(=O)N 1P003B6H [0,1,0,0,0,0|2,0,0]=3 1845 B11R1.166 Oc1ccc(c(c1)F)C(=O)O 1P003HQ1 [0,1,0,0,0,0|1,0,0]=2 1846 B11R1.166 Oc1ccc(c(c1)F)[N+](=O)[O-] 1P00BXTQ [0,1,0,0,0,0|2,0,1]=4 1847 B11R1.166 Oc1ccc(c(c1)I)[N+](=O)[O-] 1P00389B [0,1,0,0,0,0|2,0,1]=4 1848 B11R1.166 Oc1ccc(c(c1)N)C(=O)N 1P00537N [0,1,0,0,0,0|2,0,0]=3 1849 B11R1.166 Oc1ccc(c(c1)N)C(=O)O 1P00CJAM [0,1,0,0,0,0|1,0,0]=2 1850 B11R1.166 Oc1ccc(c(c1)N)[N+](=O)[O-] 1P007DYN [0,1,0,0,0,0|2,0,1]=4 1851 B11R1.166 Oc1ccc(c(c1)O)C(=O)C 1P003G9T [0,1,0,0,0,0|1,0,0]=2 1852 B11R1.166 Oc1ccc(c(c1)O)C(=O)N 1P003BLK [0,1,0,0,0,0|1,0,0]=2 1853 B11R1.166 Oc1ccc(c(c1)O)C(=O)O 1P003G9U [0,1,0,0,0,0|0,0,0]=1 1854 B11R1.166 Oc1ccc(c(c1)O)C(C)C 1P002NVY [0,1,0,0,0,0|2,0,1]=4 1855 B11R1.166 Oc1ccc(c(c1)O)[N+](=O)[O-] 1P003AGF [0,1,0,0,0,0|1,0,1]=3 1856 B11R1.166 Oc1ccc(c(n1)Cl)C(=O)O 1P003HHA [0,1,0,0,0,0|2,0,0]=3 1857 B11R1.166 Oc1cnc(c(c1)F)C(=O)O 1P01FGJO [0,1,0,0,0,0|2,0,0]=3 1858 B11R1.166 Oc1nc(Br)ccc1C(=O)O 1P01B2M4 [0,1,0,0,0,0|1,0,0]=2 1859 B11R1.166 Oc1ncc(c(c1)Cl)C(=O)O 1P005NI6 [0,1,0,0,0,0|2,0,0]=3 1860 B11R1.166 Oc1ncc(c(n1)N)C(=O)O 1P00C90A [0,1,0,0,0,0|3,0,0]=4 1861 B11R1.166 Sc1ccc(c(c1)Cl)C(=O)O 1P000CEO [0,1,0,0,0,0|1,0,0]=2 1862 B11R1.166 Sc1ccc(c(c1)F)C(=O)O 1P01BL0V [0,1,0,0,0,0|1,0,0]=2 1863 B11R1.166 Sc1ncc(c(n1)O)C(=O)N 1P01BIUI [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.166 [O-]C(=O)c1cnc(cc1Br)C 1P02816E [0,1,0,0,0,0|2,0,1]=4 1865 B11R1.166 [O-][N+](=O)c1ccc(nc1O)C 1P00BXUF [0,1,0,0,0,0|2,0,1]=4 1866 B11R1.166 [O-][N+](=O)c1ccc(nc1O)F 1P01DZGG [0,1,0,0,0,0|2,0,1]=4 1867 B11R1.167 Brc1c[nH]c(=O)c(c1)C(=O)O 1P007HFQ [0,1,0,0,0,0|1,0,1]=3 1868 B11R1.167 Brc1c[nH]c(=O)c(n1)C(=O)O 1P000RHW [0,1,0,0,0,0|2,0,1]=4 1869 B11R1.167 Brc1ccc(c(c1)B(O)O)Br 1P0003EH [0,1,0,0,0,0|2,0,1]=4 1870 B11R1.167 Brc1ccc(c(c1)B(O)O)C 1P003CEE [0,1,0,0,0,0|2,0,1]=4 1871 B11R1.167 Brc1ccc(c(c1)B(O)O)Cl 1P00GAH2 [0,1,0,0,0,0|2,0,1]=4 1872 B11R1.167 Brc1ccc(c(c1)B(O)O)F 1P0083ME [0,1,0,0,0,0|2,0,1]=4 1873 B11R1.167 Brc1ccc(c(c1)B(O)O)O 1P003XB9 [0,1,0,0,0,0|1,0,1]=3 1874 B11R1.167 Brc1ccc(c(c1)C(=N)N)F 1P00930D [0,1,0,0,0,0|3,0,0]=4 1875 B11R1.167 Brc1ccc(c(c1)C(=O)C)Br 1P00BXTV [0,1,0,0,0,0|2,0,0]=3 1876 B11R1.167 Brc1ccc(c(c1)C(=O)C)C 1P003A5Y [0,1,0,0,0,0|2,0,0]=3 1877 B11R1.167 Brc1ccc(c(c1)C(=O)C)Cl 1P008TD3 [0,1,0,0,0,0|2,0,0]=3 1878 B11R1.167 Brc1ccc(c(c1)C(=O)C)F 1P002C0I [0,1,0,0,0,0|2,0,0]=3 1879 B11R1.167 Brc1ccc(c(c1)C(=O)C)I 1P000SEJ [0,1,0,0,0,0|2,0,0]=3 1880 B11R1.167 Brc1ccc(c(c1)C(=O)C)N 1P002XVG [0,1,0,0,0,0|2,0,0]=3 1881 B11R1.167 Brc1ccc(c(c1)C(=O)C)O 1P001KWY [0,1,0,0,0,0|1,0,0]=2 1882 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)Br 1P01GL79 [0,1,0,0,0,0|2,0,0]=3 1883 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)Cl 1P00C1QE [0,1,0,0,0,0|2,0,0]=3 1884 B11R1.167 Brc1ccc(c(c1)C(=O)N)C 1P00GA8O [0,1,0,0,0,0|2,0,0]=3 1885 B11R1.167 Brc1ccc(c(c1)C(=O)N)Cl 1P002HRC [0,1,0,0,0,0|2,0,0]=3 1886 B11R1.167 Brc1ccc(c(c1)C(=O)N)F 1P00BH8H [0,1,0,0,0,0|2,0,0]=3 1887 B11R1.167 Brc1ccc(c(c1)C(=O)N)I 1P002XH0 [0,1,0,0,0,0|2,0,0]=3 1888 B11R1.167 Brc1ccc(c(c1)C(=O)N)N 1P001U9O [0,1,0,0,0,0|2,0,0]=3 1889 B11R1.167 Brc1ccc(c(c1)C(=O)N)O 1P00EAJO [0,1,0,0,0,0|1,0,0]=2 1890 B11R1.167 Brc1ccc(c(c1)C(=O)O)Br 1P0033GP [0,1,0,0,0,0|1,0,0]=2 1891 B11R1.167 Brc1ccc(c(c1)C(=O)O)C 1P0034OE [0,1,0,0,0,0|1,0,0]=2 1892 B11R1.167 Brc1ccc(c(c1)C(=O)O)Cl 1P0034O7 [0,1,0,0,0,0|1,0,0]=2 1893 B11R1.167 Brc1ccc(c(c1)C(=O)O)F 1P001ECO [0,1,0,0,0,0|1,0,0]=2 1894 B11R1.167 Brc1ccc(c(c1)C(=O)O)I 1P003MY1 [0,1,0,0,0,0|1,0,0]=2 1895 B11R1.167 Brc1ccc(c(c1)C(=O)O)N 1P0033K8 [0,1,0,0,0,0|1,0,0]=2 1896 B11R1.167 Brc1ccc(c(c1)C(=O)O)O 1P0034P9 [0,1,0,0,0,0|0,0,0]=1 1897 B11R1.167 Brc1ccc(c(c1)C(=S)N)N 1P028DWH [0,1,0,0,0,0|2,1,0]=4 1898 B11R1.167 Brc1ccc(c(c1)C(C)C)O 1P002T3U [0,1,0,0,0,0|2,0,1]=4 1899 B11R1.167 Brc1ccc(c(c1)C(O)C)F 1P00DIBW [0,1,0,0,0,0|2,0,1]=4 1900 B11R1.167 Brc1ccc(c(c1)C(O)C)N 1P021WI9 [0,1,0,0,0,0|2,0,1]=4 1901 B11R1.167 Brc1ccc(c(c1)N(=O)=O)N 1P003LE2 [0,1,0,0,0,0|2,0,1]=4 1902 B11R1.167 Brc1ccc(c(c1)[C@@H](O)C)Br 1P0240LB [0,1,0,0,0,0|2,0,1]=4 1903 B11R1.167 Brc1ccc(c(c1)[C@H](O)C)Br 1P028UY1 [0,1,0,0,0,0|2,0,1]=4 1904 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])Br 1P003GDI [0,1,0,0,0,0|2,0,1]=4 1905 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])C 1P003LE5 [0,1,0,0,0,0|2,0,1]=4 1906 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])Cl 1P001WUG [0,1,0,0,0,0|2,0,1]=4 1907 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])F 1P0034DR [0,1,0,0,0,0|2,0,1]=4 1908 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])I 1P007SZQ [0,1,0,0,0,0|2,0,1]=4 1909 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])O 1P008OZM [0,1,0,0,0,0|1,0,1]=3 1910 B11R1.167 Brc1ccc(c(c1)[N+](=O)[O-])S 1P019UG7 [0,1,0,0,0,0|1,1,1]=4 1911 B11R1.167 Brc1ccc(c(n1)C(=O)C)Br 1P024HPX [0,1,0,0,0,0|3,0,0]=4 1912 B11R1.167 Brc1ccc(c(n1)C(=O)C)C 1P0285YC [0,1,0,0,0,0|3,0,0]=4 1913 B11R1.167 Brc1ccc(c(n1)C(=O)C)F 1P0005GT [0,1,0,0,0,0|3,0,0]=4 1914 B11R1.167 Brc1ccc(c(n1)C(=O)N)N 1P00HZLQ [0,1,0,0,0,0|3,0,0]=4 1915 B11R1.167 Brc1ccc(c(n1)C(=O)O)Br 1P0079VO [0,1,0,0,0,0|2,0,0]=3 1916 B11R1.167 Brc1ccc(c(n1)C(=O)O)C 1P00957Q [0,1,0,0,0,0|2,0,0]=3 1917 B11R1.167 Brc1ccc(c(n1)C(=O)O)Cl 1P0038SP [0,1,0,0,0,0|2,0,0]=3 1918 B11R1.167 Brc1ccc(c(n1)C(=O)O)F 1P007X84 [0,1,0,0,0,0|2,0,0]=3 1919 B11R1.167 Brc1ccc(c(n1)C(=O)O)N 1P0039YC [0,1,0,0,0,0|2,0,0]=3 1920 B11R1.167 Brc1ccc(c(n1)C(=O)O)O 1P0038IO [0,1,0,0,0,0|1,0,0]=2 1921 B11R1.167 Brc1ccc(c(n1)[N+](=O)[O-])O 1P0038BI [0,1,0,0,0,0|2,0,1]=4 1922 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P000OWJ [0,1,0,0,0,0|3,0,0]=4 1923 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P028RZ2 [0,1,0,0,0,0|3,0,0]=4 1924 B11R1.167 Brc1cnc(c(c1)C(=O)C)Cl 1P008AZF [0,1,0,0,0,0|3,0,0]=4 1925 B11R1.167 Brc1cnc(c(c1)C(=O)C)F 1P003DHX [0,1,0,0,0,0|3,0,0]=4 1926 B11R1.167 Brc1cnc(c(c1)C(=O)C)N 1P01ELLE [0,1,0,0,0,0|3,0,0]=4 1927 B11R1.167 Brc1cnc(c(c1)C(=O)N)Cl 1P008R0E [0,1,0,0,0,0|3,0,0]=4 1928 B11R1.167 Brc1cnc(c(c1)C(=O)N)N 1P00ECWN [0,1,0,0,0,0|3,0,0]=4 1929 B11R1.167 Brc1cnc(c(c1)C(=O)O)Br 1P002YIF [0,1,0,0,0,0|2,0,0]=3 1930 B11R1.167 Brc1cnc(c(c1)C(=O)O)C 1P0038HX [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.167 Brc1cnc(c(c1)C(=O)O)Cl 1P002Y9V [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.167 Brc1cnc(c(c1)C(=O)O)F 1P002YB0 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.167 Brc1cnc(c(c1)C(=O)O)N 1P00DMD5 [0,1,0,0,0,0|2,0,0]=3 1934 B11R1.167 Brc1cnc(c(c1)C(=O)O)N 1P00I9WN [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.167 Brc1cnc(c(c1)C(=O)O)S 1P01AJMI [0,1,0,0,0,0|1,1,0]=3 1936 B11R1.167 Brc1cnc(c(n1)C(=O)O)Br 1P005YTP [0,1,0,0,0,0|3,0,0]=4 1937 B11R1.167 Brc1cnc(c(n1)C(=O)O)N 1P006WST [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.167 Brc1cnc(c(n1)C(=O)[O-])O 1P028VYL [0,1,0,0,0,0|2,0,1]=4 1939 B11R1.167 Brc1ncc(c(c1)C(=O)C)F 1P008ZJO [0,1,0,0,0,0|3,0,0]=4 1940 B11R1.167 Brc1ncc(c(c1)C(=O)C)O 1P008UOX [0,1,0,0,0,0|2,0,0]=3 1941 B11R1.167 Brc1ncc(c(c1)C(=O)N)F 1P01FPDF [0,1,0,0,0,0|3,0,0]=4 1942 B11R1.167 Brc1ncc(c(c1)C(=O)O)Br 1P00GUQR [0,1,0,0,0,0|2,0,0]=3 1943 B11R1.167 Brc1ncc(c(c1)C(=O)O)Cl 1P00DBQV [0,1,0,0,0,0|2,0,0]=3 1944 B11R1.167 Brc1ncc(c(c1)C(=O)O)F 1P004EJW [0,1,0,0,0,0|2,0,0]=3 1945 B11R1.167 Brc1ncc(c(c1)C(=O)O)N 1P000M6Q [0,1,0,0,0,0|2,0,0]=3 1946 B11R1.167 Cc1c[nH]c(=O)c(c1)C(=O)O 1P00CLY0 [0,1,0,0,0,0|1,0,1]=3 1947 B11R1.167 Cc1ccc(c(c1)B(O)O)Br 1P01K5RN [0,1,0,0,0,0|2,0,1]=4 1948 B11R1.167 Cc1ccc(c(c1)B(O)O)C 1P003GGT [0,1,0,0,0,0|2,0,1]=4 1949 B11R1.167 Cc1ccc(c(c1)B(O)O)Cl 1P003HFW [0,1,0,0,0,0|2,0,1]=4 1950 B11R1.167 Cc1ccc(c(c1)B(O)O)F 1P001X3D [0,1,0,0,0,0|2,0,1]=4 1951 B11R1.167 Cc1ccc(c(c1)B(O)O)O 1P002RIH [0,1,0,0,0,0|1,0,1]=3 1952 B11R1.167 Cc1ccc(c(c1)C(=O)C)Br 1P00GAT6 [0,1,0,0,0,0|2,0,0]=3 1953 B11R1.167 Cc1ccc(c(c1)C(=O)C)C 1P0033H7 [0,1,0,0,0,0|2,0,0]=3 1954 B11R1.167 Cc1ccc(c(c1)C(=O)C)Cl 1P01V4LI [0,1,0,0,0,0|2,0,0]=3 1955 B11R1.167 Cc1ccc(c(c1)C(=O)C)F 1P003BOS [0,1,0,0,0,0|2,0,0]=3 1956 B11R1.167 Cc1ccc(c(c1)C(=O)C)N 1P00BQFJ [0,1,0,0,0,0|2,0,0]=3 1957 B11R1.167 Cc1ccc(c(c1)C(=O)C)O 1P001KX0 [0,1,0,0,0,0|1,0,0]=2 1958 B11R1.167 Cc1ccc(c(c1)C(=O)Cl)C 1P00BDAF [0,1,0,0,0,0|2,0,0]=3 1959 B11R1.167 Cc1ccc(c(c1)C(=O)Cl)F 1P003HR3 [0,1,0,0,0,0|2,0,0]=3 1960 B11R1.167 Cc1ccc(c(c1)C(=O)N)C 1P00EO1G [0,1,0,0,0,0|2,0,0]=3 1961 B11R1.167 Cc1ccc(c(c1)C(=O)N)F 1P00GVBI [0,1,0,0,0,0|2,0,0]=3 1962 B11R1.167 Cc1ccc(c(c1)C(=O)N)N 1P00772Z [0,1,0,0,0,0|2,0,0]=3 1963 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 1P00380H [0,1,0,0,0,0|1,0,0]=2 1964 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br 1P003H6R [0,1,0,0,0,0|1,0,0]=2 1965 B11R1.167 Cc1ccc(c(c1)C(=O)O)C 1P003GGE [0,1,0,0,0,0|1,0,0]=2 1966 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl 1P0037FO [0,1,0,0,0,0|1,0,0]=2 1967 B11R1.167 Cc1ccc(c(c1)C(=O)O)F 1P003NOJ [0,1,0,0,0,0|1,0,0]=2 1968 B11R1.167 Cc1ccc(c(c1)C(=O)O)I 1P00D96L [0,1,0,0,0,0|1,0,0]=2 1969 B11R1.167 Cc1ccc(c(c1)C(=O)O)N 1P003GXZ [0,1,0,0,0,0|1,0,0]=2 1970 B11R1.167 Cc1ccc(c(c1)C(=O)O)O 1P003ZSU [0,1,0,0,0,0|0,0,0]=1 1971 B11R1.167 Cc1ccc(c(c1)C(C)C)O 1P00DBZZ [0,1,0,0,0,0|2,0,1]=4 1972 B11R1.167 Cc1ccc(c(c1)C(O)C)C 1P00BZR5 [0,1,0,0,0,0|2,0,1]=4 1973 B11R1.167 Cc1ccc(c(c1)N(C)C)O 1P02861G [0,1,0,0,0,0|3,0,0]=4 1974 B11R1.167 Cc1ccc(c(c1)[C@@H](O)C)C 1P019R13 [0,1,0,0,0,0|2,0,1]=4 1975 B11R1.167 Cc1ccc(c(c1)[C@H](O)C)C 1P019R14 [0,1,0,0,0,0|2,0,1]=4 1976 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])Br 1P003LF9 [0,1,0,0,0,0|2,0,1]=4 1977 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])C 1P003Y52 [0,1,0,0,0,0|2,0,1]=4 1978 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])Cl 1P003XB7 [0,1,0,0,0,0|2,0,1]=4 1979 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])F 1P003LV7 [0,1,0,0,0,0|2,0,1]=4 1980 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])I 1P003M15 [0,1,0,0,0,0|2,0,1]=4 1981 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])N 1P003XGV [0,1,0,0,0,0|2,0,1]=4 1982 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])O 1P003M6U [0,1,0,0,0,0|1,0,1]=3 1983 B11R1.167 Cc1ccc(c(n1)C(=O)O)Br 1P0036YE [0,1,0,0,0,0|2,0,0]=3 1984 B11R1.167 Cc1ccc(c(n1)C(=O)O)Br 1P01BJRC [0,1,0,0,0,0|2,0,0]=3 1985 B11R1.167 Cc1ccc(c(n1)C(=O)O)C 1P004THZ [0,1,0,0,0,0|2,0,0]=3 1986 B11R1.167 Cc1ccc(c(n1)C(=O)O)C 1P01FKMT [0,1,0,0,0,0|2,0,0]=3 1987 B11R1.167 Cc1ccc(c(n1)C(=O)O)Cl 1P00IG6V [0,1,0,0,0,0|2,0,0]=3 1988 B11R1.167 Cc1ccc(c(n1)C(=O)O)F 1P009DUM [0,1,0,0,0,0|2,0,0]=3 1989 B11R1.167 Cc1ccc(c(n1)C(=O)O)F 1P028ID0 [0,1,0,0,0,0|2,0,0]=3 1990 B11R1.167 Cc1ccc(c(n1)C(=O)O)N 1P00DNDY [0,1,0,0,0,0|2,0,0]=3 1991 B11R1.167 Cc1ccc(c(n1)C(=O)O)O 1P001H5Y [0,1,0,0,0,0|1,0,0]=2 1992 B11R1.167 Cc1ccc(c(n1)[N+](=O)[O-])O 1P001NPL [0,1,0,0,0,0|2,0,1]=4 1993 B11R1.167 Cc1cnc(c(c1)C(=O)C)Cl 1P0048IR [0,1,0,0,0,0|3,0,0]=4 1994 B11R1.167 Cc1cnc(c(c1)C(=O)N)Cl 1P00ELLE [0,1,0,0,0,0|3,0,0]=4 1995 B11R1.167 Cc1cnc(c(c1)C(=O)N)N 1P0007BB [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.167 Cc1cnc(c(c1)C(=O)O)C 1P028OML [0,1,0,0,0,0|2,0,0]=3 1997 B11R1.167 Cc1cnc(c(c1)C(=O)O)Cl 1P00FBJ9 [0,1,0,0,0,0|2,0,0]=3 1998 B11R1.167 Cc1cnc(c(c1)C(=O)O)F 1P008YBJ [0,1,0,0,0,0|2,0,0]=3 1999 B11R1.167 Cc1cnc(c(c1)C(=O)O)N 1P00D8VH [0,1,0,0,0,0|2,0,0]=3 2000 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])O 1P008PY0 [0,1,0,0,0,0|2,0,1]=4 2001 B11R1.167 Cc1cnc(c(n1)C(=O)O)C 1P00BGLH [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.167 Cc1cnc(c(n1)C(=O)O)N 1P00DIDA [0,1,0,0,0,0|3,0,0]=4 2003 B11R1.167 Cc1n[nH]c(=O)c(c1)C(=O)O 1P005B7J [0,1,0,0,0,0|2,0,1]=4 2004 B11R1.167 Cc1ncc(c(c1)C(=O)C)Cl 1P0292A1 [0,1,0,0,0,0|3,0,0]=4 2005 B11R1.167 Cc1ncc(c(c1)C(=O)O)Br 1P01SK8R [0,1,0,0,0,0|2,0,0]=3 2006 B11R1.167 Cc1ncc(c(c1)C(=O)O)C 1P0066YL [0,1,0,0,0,0|2,0,0]=3 2007 B11R1.167 Cc1ncc(c(c1)C(=O)O)C 1P01FKMU [0,1,0,0,0,0|2,0,0]=3 2008 B11R1.167 Cc1ncc(c(c1)C(=O)O)Cl 1P008URR [0,1,0,0,0,0|2,0,0]=3 2009 B11R1.167 Cc1ncc(c(c1)C(=O)O)F 1P00IFNY [0,1,0,0,0,0|2,0,0]=3 2010 B11R1.167 Cc1ncc(c(c1)C(=O)O)N 1P004AVZ [0,1,0,0,0,0|2,0,0]=3 2011 B11R1.167 Cc1ncc(c(c1)C(=O)O)N 1P00HYGF [0,1,0,0,0,0|2,0,0]=3 2012 B11R1.167 Cc1ncc(c(c1)C(=O)O)O 1P00J3B5 [0,1,0,0,0,0|1,0,0]=2 2013 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br 1P00035L [0,1,0,0,0,0|3,0,0]=4 2014 B11R1.167 Cc1ncc(c(n1)C(=O)O)Cl 1P0059AR [0,1,0,0,0,0|3,0,0]=4 2015 B11R1.167 Cc1nnc(c(c1)C(=O)O)C 1P019T97 [0,1,0,0,0,0|3,0,0]=4 2016 B11R1.167 Cc1nnc(c(c1)C(=O)O)Cl 1P00GVD4 [0,1,0,0,0,0|3,0,0]=4 2017 B11R1.167 Clc1ccc(c(c1)B(O)O)Br 1P001698 [0,1,0,0,0,0|2,0,1]=4 2018 B11R1.167 Clc1ccc(c(c1)B(O)O)C 1P001LPF [0,1,0,0,0,0|2,0,1]=4 2019 B11R1.167 Clc1ccc(c(c1)B(O)O)Cl 1P00HUDA [0,1,0,0,0,0|2,0,1]=4 2020 B11R1.167 Clc1ccc(c(c1)B(O)O)F 1P003N3C [0,1,0,0,0,0|2,0,1]=4 2021 B11R1.167 Clc1ccc(c(c1)B(O)O)N 1P00020F [0,1,0,0,0,0|2,0,1]=4 2022 B11R1.167 Clc1ccc(c(c1)B(O)O)O 1P003N3K [0,1,0,0,0,0|1,0,1]=3 2023 B11R1.167 Clc1ccc(c(c1)C(=N)N)F 1P005OAH [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.167 Clc1ccc(c(c1)C(=N)N)F 1P00HF7L [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.167 Clc1ccc(c(c1)C(=N)N)O 1P01BDKX [0,1,0,0,0,0|2,0,0]=3 2026 B11R1.167 Clc1ccc(c(c1)C(=O)C)Br 1P00H1EO [0,1,0,0,0,0|2,0,0]=3 2027 B11R1.167 Clc1ccc(c(c1)C(=O)C)C 1P00EKVP [0,1,0,0,0,0|2,0,0]=3 2028 B11R1.167 Clc1ccc(c(c1)C(=O)C)Cl 1P002PUD [0,1,0,0,0,0|2,0,0]=3 2029 B11R1.167 Clc1ccc(c(c1)C(=O)C)F 1P00DD5T [0,1,0,0,0,0|2,0,0]=3 2030 B11R1.167 Clc1ccc(c(c1)C(=O)C)N 1P001YL0 [0,1,0,0,0,0|2,0,0]=3 2031 B11R1.167 Clc1ccc(c(c1)C(=O)C)O 1P001KWZ [0,1,0,0,0,0|1,0,0]=2 2032 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)Cl 1P002VSM [0,1,0,0,0,0|2,0,0]=3 2033 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)F 1P003N37 [0,1,0,0,0,0|2,0,0]=3 2034 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)O 1P007Z4X [0,1,0,0,0,0|1,0,0]=2 2035 B11R1.167 Clc1ccc(c(c1)C(=O)N)C 1P01A5IM [0,1,0,0,0,0|2,0,0]=3 2036 B11R1.167 Clc1ccc(c(c1)C(=O)N)Cl 1P003BLU [0,1,0,0,0,0|2,0,0]=3 2037 B11R1.167 Clc1ccc(c(c1)C(=O)N)F 1P002SHR [0,1,0,0,0,0|2,0,0]=3 2038 B11R1.167 Clc1ccc(c(c1)C(=O)N)N 1P0036CW [0,1,0,0,0,0|2,0,0]=3 2039 B11R1.167 Clc1ccc(c(c1)C(=O)N)O 1P003N5N [0,1,0,0,0,0|1,0,0]=2 2040 B11R1.167 Clc1ccc(c(c1)C(=O)O)Br 1P003H61 [0,1,0,0,0,0|1,0,0]=2 2041 B11R1.167 Clc1ccc(c(c1)C(=O)O)C 1P003N43 [0,1,0,0,0,0|1,0,0]=2 2042 B11R1.167 Clc1ccc(c(c1)C(=O)O)Cl 1P0033GU [0,1,0,0,0,0|1,0,0]=2 2043 B11R1.167 Clc1ccc(c(c1)C(=O)O)F 1P003N34 [0,1,0,0,0,0|1,0,0]=2 2044 B11R1.167 Clc1ccc(c(c1)C(=O)O)I 1P009DJG [0,1,0,0,0,0|1,0,0]=2 2045 B11R1.167 Clc1ccc(c(c1)C(=O)O)N 1P0033KC [0,1,0,0,0,0|1,0,0]=2 2046 B11R1.167 Clc1ccc(c(c1)C(=O)O)O 1P0037U3 [0,1,0,0,0,0|0,0,0]=1 2047 B11R1.167 Clc1ccc(c(c1)C(=O)O)S 1P002983 [0,1,0,0,0,0|0,1,0]=2 2048 B11R1.167 Clc1ccc(c(c1)C(=O)[O-])Cl 1P00EL0D [0,1,0,0,0,0|1,0,1]=3 2049 B11R1.167 Clc1ccc(c(c1)C(=S)N)F 1P0289MW [0,1,0,0,0,0|2,1,0]=4 2050 B11R1.167 Clc1ccc(c(c1)C(O)C)C 1P00EM52 [0,1,0,0,0,0|2,0,1]=4 2051 B11R1.167 Clc1ccc(c(c1)C(O)C)Cl 1P001FES [0,1,0,0,0,0|2,0,1]=4 2052 B11R1.167 Clc1ccc(c(c1)[C@@H](N)C)O 1P009Z6F [0,1,0,0,0,0|2,0,1]=4 2053 B11R1.167 Clc1ccc(c(c1)[C@@H](O)C)Cl 1P01AIVI [0,1,0,0,0,0|2,0,1]=4 2054 B11R1.167 Clc1ccc(c(c1)[C@@H](O)C)F 1P01A3U4 [0,1,0,0,0,0|2,0,1]=4 2055 B11R1.167 Clc1ccc(c(c1)[C@H](N)C)O 1P000K2T [0,1,0,0,0,0|2,0,1]=4 2056 B11R1.167 Clc1ccc(c(c1)[C@H](O)C)Cl 1P019X9P [0,1,0,0,0,0|2,0,1]=4 2057 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])Br 1P003H64 [0,1,0,0,0,0|2,0,1]=4 2058 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])C 1P007694 [0,1,0,0,0,0|2,0,1]=4 2059 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])Cl 1P003XUD [0,1,0,0,0,0|2,0,1]=4 2060 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])F 1P003N3A [0,1,0,0,0,0|2,0,1]=4 2061 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])I 1P003LIQ [0,1,0,0,0,0|2,0,1]=4 2062 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])N 1P005OUF [0,1,0,0,0,0|2,0,1]=4 2063 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])O 1P003LKS [0,1,0,0,0,0|1,0,1]=3 2064 B11R1.167 Clc1ccc(c(n1)C(=O)C)Cl 1P00IUP8 [0,1,0,0,0,0|3,0,0]=4 2065 B11R1.167 Clc1ccc(c(n1)C(=O)C)F 1P01C874 [0,1,0,0,0,0|3,0,0]=4 2066 B11R1.167 Clc1ccc(c(n1)C(=O)N)Br 1P000Y2Y [0,1,0,0,0,0|3,0,0]=4 2067 B11R1.167 Clc1ccc(c(n1)C(=O)N)C 1P01XAI0 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.167 Clc1ccc(c(n1)C(=O)N)Cl 1P00ADE2 [0,1,0,0,0,0|3,0,0]=4 2069 B11R1.167 Clc1ccc(c(n1)C(=O)N)N 1P0021EB [0,1,0,0,0,0|3,0,0]=4 2070 B11R1.167 Clc1ccc(c(n1)C(=O)O)Br 1P00GTUK [0,1,0,0,0,0|2,0,0]=3 2071 B11R1.167 Clc1ccc(c(n1)C(=O)O)C 1P000R0C [0,1,0,0,0,0|2,0,0]=3 2072 B11R1.167 Clc1ccc(c(n1)C(=O)O)Cl 1P00340O [0,1,0,0,0,0|2,0,0]=3 2073 B11R1.167 Clc1ccc(c(n1)C(=O)O)F 1P003NMF [0,1,0,0,0,0|2,0,0]=3 2074 B11R1.167 Clc1ccc(c(n1)C(=O)O)N 1P00341X [0,1,0,0,0,0|2,0,0]=3 2075 B11R1.167 Clc1ccc(c(n1)[N+](=O)[O-])O 1P004DTL [0,1,0,0,0,0|2,0,1]=4 2076 B11R1.167 Clc1cnc(c(c1)C(=O)C)Cl 1P00IUAW [0,1,0,0,0,0|3,0,0]=4 2077 B11R1.167 Clc1cnc(c(c1)C(=O)C)F 1P01JWGL [0,1,0,0,0,0|3,0,0]=4 2078 B11R1.167 Clc1cnc(c(c1)C(=O)N)Cl 1P005YY3 [0,1,0,0,0,0|3,0,0]=4 2079 B11R1.167 Clc1cnc(c(c1)C(=O)N)N 1P00EIVG [0,1,0,0,0,0|3,0,0]=4 2080 B11R1.167 Clc1cnc(c(c1)C(=O)O)Br 1P00EA8I [0,1,0,0,0,0|2,0,0]=3 2081 B11R1.167 Clc1cnc(c(c1)C(=O)O)C 1P007BS1 [0,1,0,0,0,0|2,0,0]=3 2082 B11R1.167 Clc1cnc(c(c1)C(=O)O)Cl 1P003GE7 [0,1,0,0,0,0|2,0,0]=3 2083 B11R1.167 Clc1cnc(c(c1)C(=O)O)F 1P003N39 [0,1,0,0,0,0|2,0,0]=3 2084 B11R1.167 Clc1cnc(c(c1)C(=O)O)N 1P00D8VQ [0,1,0,0,0,0|2,0,0]=3 2085 B11R1.167 Clc1cnc(c(c1)C(=O)O)O 1P003N3J [0,1,0,0,0,0|1,0,0]=2 2086 B11R1.167 Clc1cnc(c(c1)C(=O)[O-])F 1P01BRZM [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.167 Clc1cnc(c(n1)C(=O)O)Br 1P000RO4 [0,1,0,0,0,0|3,0,0]=4 2088 B11R1.167 Clc1cnc(c(n1)C(=O)O)Cl 1P00D5QQ [0,1,0,0,0,0|3,0,0]=4 2089 B11R1.167 Clc1cnc(c(n1)C(=O)O)N 1P00C1PG [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.167 Clc1ncc(c(c1)C(=O)C)Br 1P00A6DR [0,1,0,0,0,0|3,0,0]=4 2091 B11R1.167 Clc1ncc(c(c1)C(=O)C)C 1P024HU8 [0,1,0,0,0,0|3,0,0]=4 2092 B11R1.167 Clc1ncc(c(c1)C(=O)C)Cl 1P00ICW7 [0,1,0,0,0,0|3,0,0]=4 2093 B11R1.167 Clc1ncc(c(c1)C(=O)C)N 1P01DYYZ [0,1,0,0,0,0|3,0,0]=4 2094 B11R1.167 Clc1ncc(c(c1)C(=O)Cl)Cl 1P01DVDJ [0,1,0,0,0,0|3,0,0]=4 2095 B11R1.167 Clc1ncc(c(c1)C(=O)N)Cl 1P00AAI5 [0,1,0,0,0,0|3,0,0]=4 2096 B11R1.167 Clc1ncc(c(c1)C(=O)N)N 1P00162O [0,1,0,0,0,0|3,0,0]=4 2097 B11R1.167 Clc1ncc(c(c1)C(=O)O)Br 1P004AI8 [0,1,0,0,0,0|2,0,0]=3 2098 B11R1.167 Clc1ncc(c(c1)C(=O)O)C 1P019T95 [0,1,0,0,0,0|2,0,0]=3 2099 B11R1.167 Clc1ncc(c(c1)C(=O)O)Cl 1P003GEG [0,1,0,0,0,0|2,0,0]=3 2100 B11R1.167 Clc1ncc(c(c1)C(=O)O)F 1P004K0B [0,1,0,0,0,0|2,0,0]=3 2101 B11R1.167 Clc1ncc(c(c1)C(=O)O)N 1P0036PB [0,1,0,0,0,0|2,0,0]=3 2102 B11R1.167 Clc1ncc(c(c1)C(=O)O)O 1P003HFO [0,1,0,0,0,0|1,0,0]=2 2103 B11R1.167 Clc1ncc(c(n1)C(=O)O)C 1P006454 [0,1,0,0,0,0|3,0,0]=4 2104 B11R1.167 Clc1ncc(c(n1)C(=O)O)F 1P0221GO [0,1,0,0,0,0|3,0,0]=4 2105 B11R1.167 Clc1ncc(c(n1)C(=O)O)N 1P009KNK [0,1,0,0,0,0|3,0,0]=4 2106 B11R1.167 Clc1nnc(c(c1)C(=O)O)C 1P0291JI [0,1,0,0,0,0|3,0,0]=4 2107 B11R1.167 Clc1nnc(c(c1)C(=O)O)Cl 1P00340N [0,1,0,0,0,0|3,0,0]=4 2108 B11R1.167 Clc1nnc(c(c1)C(=O)O)N 1P028UVS [0,1,0,0,0,0|3,0,0]=4 2109 B11R1.167 Clc1nnc(c(c1)C(=O)O)O 1P00DIC6 [0,1,0,0,0,0|2,0,0]=3 2110 B11R1.167 Cn1ccc(=O)c(c1)C(=O)N 1P00G5AZ [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.167 Cn1ccc(=O)c(c1)C(=O)O 1P00938H [0,1,0,0,0,0|1,0,1]=3 2112 B11R1.167 Fc1c[nH]c(=O)c(c1)C(=O)N 1P01EEHT [0,1,0,0,0,0|2,0,1]=4 2113 B11R1.167 Fc1ccc(c(c1)B(O)O)Br 1P00IK6N [0,1,0,0,0,0|2,0,1]=4 2114 B11R1.167 Fc1ccc(c(c1)B(O)O)C 1P001UMT [0,1,0,0,0,0|2,0,1]=4 2115 B11R1.167 Fc1ccc(c(c1)B(O)O)Cl 1P00D995 [0,1,0,0,0,0|2,0,1]=4 2116 B11R1.167 Fc1ccc(c(c1)B(O)O)F 1P003GEZ [0,1,0,0,0,0|2,0,1]=4 2117 B11R1.167 Fc1ccc(c(c1)B(O)O)N 1P007X90 [0,1,0,0,0,0|2,0,1]=4 2118 B11R1.167 Fc1ccc(c(c1)B(O)O)O 1P002RII [0,1,0,0,0,0|1,0,1]=3 2119 B11R1.167 Fc1ccc(c(c1)C(=C)C)N 1P01XCFK [0,1,0,0,0,0|3,0,0]=4 2120 B11R1.167 Fc1ccc(c(c1)C(=N)N)F 1P004DCN [0,1,0,0,0,0|3,0,0]=4 2121 B11R1.167 Fc1ccc(c(c1)C(=O)C)Br 1P0002WR [0,1,0,0,0,0|2,0,0]=3 2122 B11R1.167 Fc1ccc(c(c1)C(=O)C)C 1P002YTO [0,1,0,0,0,0|2,0,0]=3 2123 B11R1.167 Fc1ccc(c(c1)C(=O)C)Cl 1P002ZGZ [0,1,0,0,0,0|2,0,0]=3 2124 B11R1.167 Fc1ccc(c(c1)C(=O)C)F 1P002BMD [0,1,0,0,0,0|2,0,0]=3 2125 B11R1.167 Fc1ccc(c(c1)C(=O)C)I 1P0036EC [0,1,0,0,0,0|2,0,0]=3 2126 B11R1.167 Fc1ccc(c(c1)C(=O)C)N 1P002NO5 [0,1,0,0,0,0|2,0,0]=3 2127 B11R1.167 Fc1ccc(c(c1)C(=O)C)O 1P0034Q9 [0,1,0,0,0,0|1,0,0]=2 2128 B11R1.167 Fc1ccc(c(c1)C(=O)Cl)Br 1P007SOY [0,1,0,0,0,0|2,0,0]=3 2129 B11R1.167 Fc1ccc(c(c1)C(=O)Cl)F 1P003GF2 [0,1,0,0,0,0|2,0,0]=3 2130 B11R1.167 Fc1ccc(c(c1)C(=O)N)Br 1P0002WQ [0,1,0,0,0,0|2,0,0]=3 2131 B11R1.167 Fc1ccc(c(c1)C(=O)N)C 1P0021B5 [0,1,0,0,0,0|2,0,0]=3 2132 B11R1.167 Fc1ccc(c(c1)C(=O)N)Cl 1P003HFA [0,1,0,0,0,0|2,0,0]=3 2133 B11R1.167 Fc1ccc(c(c1)C(=O)N)F 1P003GEY [0,1,0,0,0,0|2,0,0]=3 2134 B11R1.167 Fc1ccc(c(c1)C(=O)N)N 1P0037FW [0,1,0,0,0,0|2,0,0]=3 2135 B11R1.167 Fc1ccc(c(c1)C(=O)N)O 1P01B5Y0 [0,1,0,0,0,0|1,0,0]=2 2136 B11R1.167 Fc1ccc(c(c1)C(=O)O)Br 1P0033MA [0,1,0,0,0,0|1,0,0]=2 2137 B11R1.167 Fc1ccc(c(c1)C(=O)O)C 1P0033UR [0,1,0,0,0,0|1,0,0]=2 2138 B11R1.167 Fc1ccc(c(c1)C(=O)O)Cl 1P003HFB [0,1,0,0,0,0|1,0,0]=2 2139 B11R1.167 Fc1ccc(c(c1)C(=O)O)F 1P003GF0 [0,1,0,0,0,0|1,0,0]=2 2140 B11R1.167 Fc1ccc(c(c1)C(=O)O)I 1P003N7F [0,1,0,0,0,0|1,0,0]=2 2141 B11R1.167 Fc1ccc(c(c1)C(=O)O)N 1P003GXN [0,1,0,0,0,0|1,0,0]=2 2142 B11R1.167 Fc1ccc(c(c1)C(=O)O)O 1P00I7A4 [0,1,0,0,0,0|0,0,0]=1 2143 B11R1.167 Fc1ccc(c(c1)C(=O)O)S 1P000QTN [0,1,0,0,0,0|0,1,0]=2 2144 B11R1.167 Fc1ccc(c(c1)C(=O)[O-])F 1P00DAX6 [0,1,0,0,0,0|1,0,1]=3 2145 B11R1.167 Fc1ccc(c(c1)C(=S)N)Br 1P028VWK [0,1,0,0,0,0|2,1,0]=4 2146 B11R1.167 Fc1ccc(c(c1)C(=S)N)F 1P01BCFQ [0,1,0,0,0,0|2,1,0]=4 2147 B11R1.167 Fc1ccc(c(c1)C(=S)N)N 1P028ELG [0,1,0,0,0,0|2,1,0]=4 2148 B11R1.167 Fc1ccc(c(c1)C(O)C)F 1P00CI5N [0,1,0,0,0,0|2,0,1]=4 2149 B11R1.167 Fc1ccc(c(c1)N(=O)=O)O 1P003I8Q [0,1,0,0,0,0|1,0,1]=3 2150 B11R1.167 Fc1ccc(c(c1)[C@@H](N)C)O 1P01KLSY [0,1,0,0,0,0|2,0,1]=4 2151 B11R1.167 Fc1ccc(c(c1)[C@@H](O)C)Br 1P028AGV [0,1,0,0,0,0|2,0,1]=4 2152 B11R1.167 Fc1ccc(c(c1)[C@@H](O)C)C 1P01A48B [0,1,0,0,0,0|2,0,1]=4 2153 B11R1.167 Fc1ccc(c(c1)[C@@H](O)C)Cl 1P028ZWP [0,1,0,0,0,0|2,0,1]=4 2154 B11R1.167 Fc1ccc(c(c1)[C@@H](O)C)F 1P009X3W [0,1,0,0,0,0|2,0,1]=4 2155 B11R1.167 Fc1ccc(c(c1)[C@@H](O)C)I 1P001DK3 [0,1,0,0,0,0|2,0,1]=4 2156 B11R1.167 Fc1ccc(c(c1)[C@H](N)C)O 1P01XDRI [0,1,0,0,0,0|2,0,1]=4 2157 B11R1.167 Fc1ccc(c(c1)[C@H](N)C)O 1P021N92 [0,1,0,0,0,0|2,0,1]=4 2158 B11R1.167 Fc1ccc(c(c1)[C@H](O)C)Br 1P027N79 [0,1,0,0,0,0|2,0,1]=4 2159 B11R1.167 Fc1ccc(c(c1)[C@H](O)C)C 1P01A48A [0,1,0,0,0,0|2,0,1]=4 2160 B11R1.167 Fc1ccc(c(c1)[C@H](O)C)Cl 1P028CA6 [0,1,0,0,0,0|2,0,1]=4 2161 B11R1.167 Fc1ccc(c(c1)[C@H](O)C)F 1P019X9J [0,1,0,0,0,0|2,0,1]=4 2162 B11R1.167 Fc1ccc(c(c1)[C@H](O)C)I 1P001DJU [0,1,0,0,0,0|2,0,1]=4 2163 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])Br 1P003H6F [0,1,0,0,0,0|2,0,1]=4 2164 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])C 1P003LU8 [0,1,0,0,0,0|2,0,1]=4 2165 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])Cl 1P00I7A5 [0,1,0,0,0,0|2,0,1]=4 2166 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])F 1P003E50 [0,1,0,0,0,0|2,0,1]=4 2167 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])I 1P003N7G [0,1,0,0,0,0|2,0,1]=4 2168 B11R1.167 Fc1ccc(c(c1)[N+](=O)[O-])N 1P003LU5 [0,1,0,0,0,0|2,0,1]=4 2169 B11R1.167 Fc1ccc(c(n1)C(=O)C)Br 1P0022RS [0,1,0,0,0,0|3,0,0]=4 2170 B11R1.167 Fc1ccc(c(n1)C(=O)O)Br 1P0039F2 [0,1,0,0,0,0|2,0,0]=3 2171 B11R1.167 Fc1ccc(c(n1)C(=O)O)C 1P01FQ80 [0,1,0,0,0,0|2,0,0]=3 2172 B11R1.167 Fc1ccc(c(n1)C(=O)O)Cl 1P01DVIX [0,1,0,0,0,0|2,0,0]=3 2173 B11R1.167 Fc1ccc(c(n1)C(=O)O)F 1P0039VH [0,1,0,0,0,0|2,0,0]=3 2174 B11R1.167 Fc1cnc(c(c1)C(=O)C)Cl 1P003DAB [0,1,0,0,0,0|3,0,0]=4 2175 B11R1.167 Fc1cnc(c(c1)C(=O)C)F 1P001N6P [0,1,0,0,0,0|3,0,0]=4 2176 B11R1.167 Fc1cnc(c(c1)C(=O)N)C 1P028C42 [0,1,0,0,0,0|3,0,0]=4 2177 B11R1.167 Fc1cnc(c(c1)C(=O)N)Cl 1P005D1T [0,1,0,0,0,0|3,0,0]=4 2178 B11R1.167 Fc1cnc(c(c1)C(=O)N)N 1P01FZZC [0,1,0,0,0,0|3,0,0]=4 2179 B11R1.167 Fc1cnc(c(c1)C(=O)O)Br 1P00C7NY [0,1,0,0,0,0|2,0,0]=3 2180 B11R1.167 Fc1cnc(c(c1)C(=O)O)Cl 1P003HFD [0,1,0,0,0,0|2,0,0]=3 2181 B11R1.167 Fc1cnc(c(c1)C(=O)O)F 1P004R93 [0,1,0,0,0,0|2,0,0]=3 2182 B11R1.167 Fc1cnc(c(c1)C(=O)O)N 1P000PSX [0,1,0,0,0,0|2,0,0]=3 2183 B11R1.167 Fc1cnc(c(c1)C(=O)O)O 1P004K0A [0,1,0,0,0,0|1,0,0]=2 2184 B11R1.167 Fc1ncc(c(c1)C(=O)C)F 1P028D18 [0,1,0,0,0,0|3,0,0]=4 2185 B11R1.167 Fc1ncc(c(c1)C(=O)O)Br 1P0015ER [0,1,0,0,0,0|2,0,0]=3 2186 B11R1.167 Fc1ncc(c(c1)C(=O)O)C 1P0095OF [0,1,0,0,0,0|2,0,0]=3 2187 B11R1.167 Fc1ncc(c(c1)C(=O)O)Cl 1P024FE1 [0,1,0,0,0,0|2,0,0]=3 2188 B11R1.167 Fc1ncc(c(c1)C(=O)O)F 1P004NNJ [0,1,0,0,0,0|2,0,0]=3 2189 B11R1.167 Fc1ncc(c(c1)C(=O)O)I 1P0291CF [0,1,0,0,0,0|2,0,0]=3 2190 B11R1.167 Fc1ncc(c(c1)C(=O)O)N 1P007UP3 [0,1,0,0,0,0|2,0,0]=3 2191 B11R1.167 Ic1ccc(c(c1)B(O)O)F 1P003HQX [0,1,0,0,0,0|2,0,1]=4 2192 B11R1.167 Ic1ccc(c(c1)C(=O)C)Br 1P0281NL [0,1,0,0,0,0|2,0,0]=3 2193 B11R1.167 Ic1ccc(c(c1)C(=O)C)Cl 1P01JKQA [0,1,0,0,0,0|2,0,0]=3 2194 B11R1.167 Ic1ccc(c(c1)C(=O)C)F 1P00HDLJ [0,1,0,0,0,0|2,0,0]=3 2195 B11R1.167 Ic1ccc(c(c1)C(=O)C)O 1P0061WY [0,1,0,0,0,0|1,0,0]=2 2196 B11R1.167 Ic1ccc(c(c1)C(=O)Cl)Cl 1P00I5R6 [0,1,0,0,0,0|2,0,0]=3 2197 B11R1.167 Ic1ccc(c(c1)C(=O)N)Br 1P00IEKG [0,1,0,0,0,0|2,0,0]=3 2198 B11R1.167 Ic1ccc(c(c1)C(=O)N)N 1P00BZXF [0,1,0,0,0,0|2,0,0]=3 2199 B11R1.167 Ic1ccc(c(c1)C(=O)O)Br 1P0036BE [0,1,0,0,0,0|1,0,0]=2 2200 B11R1.167 Ic1ccc(c(c1)C(=O)O)C 1P003N9R [0,1,0,0,0,0|1,0,0]=2 2201 B11R1.167 Ic1ccc(c(c1)C(=O)O)Cl 1P002FE4 [0,1,0,0,0,0|1,0,0]=2 2202 B11R1.167 Ic1ccc(c(c1)C(=O)O)F 1P000N3G [0,1,0,0,0,0|1,0,0]=2 2203 B11R1.167 Ic1ccc(c(c1)C(=O)O)I 1P001HUM [0,1,0,0,0,0|1,0,0]=2 2204 B11R1.167 Ic1ccc(c(c1)C(=O)O)N 1P0033KH [0,1,0,0,0,0|1,0,0]=2 2205 B11R1.167 Ic1ccc(c(c1)C(=O)O)O 1P003HVG [0,1,0,0,0,0|0,0,0]=1 2206 B11R1.167 Ic1ccc(c(c1)C(C)C)O 1P0282JJ [0,1,0,0,0,0|2,0,1]=4 2207 B11R1.167 Ic1ccc(c(c1)C(O)C)Br 1P028WV7 [0,1,0,0,0,0|2,0,1]=4 2208 B11R1.167 Ic1ccc(c(c1)N(=O)=O)F 1P007A5E [0,1,0,0,0,0|2,0,1]=4 2209 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])Br 1P00FIBB [0,1,0,0,0,0|2,0,1]=4 2210 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])C 1P003M0Z [0,1,0,0,0,0|2,0,1]=4 2211 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])Cl 1P00C7VU [0,1,0,0,0,0|2,0,1]=4 2212 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])I 1P004290 [0,1,0,0,0,0|2,0,1]=4 2213 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])N 1P002J8M [0,1,0,0,0,0|2,0,1]=4 2214 B11R1.167 Ic1ccc(c(c1)[N+](=O)[O-])O 1P0039CC [0,1,0,0,0,0|1,0,1]=3 2215 B11R1.167 Ic1cnc(c(c1)C(=O)O)Br 1P00EQR8 [0,1,0,0,0,0|2,0,0]=3 2216 B11R1.167 Ic1cnc(c(c1)C(=O)O)Cl 1P00EAYU [0,1,0,0,0,0|2,0,0]=3 2217 B11R1.167 Ic1cnc(c(c1)C(=O)O)N 1P00DIEJ [0,1,0,0,0,0|2,0,0]=3 2218 B11R1.167 Ic1cnc(c(c1)C(=O)O)O 1P00772C [0,1,0,0,0,0|1,0,0]=2 2219 B11R1.167 Ic1cnc(c(c1)[N+](=O)[O-])O 1P003N9W [0,1,0,0,0,0|2,0,1]=4 2220 B11R1.167 Ic1cnc(c(n1)C(=O)O)N 1P008F9C [0,1,0,0,0,0|3,0,0]=4 2221 B11R1.167 Nc1ccc(c(c1)B(O)O)C 1P00020E [0,1,0,0,0,0|2,0,1]=4 2222 B11R1.167 Nc1ccc(c(c1)C(=O)C)Br 1P001MLC [0,1,0,0,0,0|2,0,0]=3 2223 B11R1.167 Nc1ccc(c(c1)C(=O)C)C 1P00BQAS [0,1,0,0,0,0|2,0,0]=3 2224 B11R1.167 Nc1ccc(c(c1)C(=O)C)Cl 1P01KYYJ [0,1,0,0,0,0|2,0,0]=3 2225 B11R1.167 Nc1ccc(c(c1)C(=O)C)F 1P00FGTC [0,1,0,0,0,0|2,0,0]=3 2226 B11R1.167 Nc1ccc(c(c1)C(=O)C)F 1P01B8CU [0,1,0,0,0,0|2,0,0]=3 2227 B11R1.167 Nc1ccc(c(c1)C(=O)C)O 1P00DCA9 [0,1,0,0,0,0|1,0,0]=2 2228 B11R1.167 Nc1ccc(c(c1)C(=O)N)Br 1P00J2KH [0,1,0,0,0,0|2,0,0]=3 2229 B11R1.167 Nc1ccc(c(c1)C(=O)N)C 1P00DHRU [0,1,0,0,0,0|2,0,0]=3 2230 B11R1.167 Nc1ccc(c(c1)C(=O)N)Cl 1P007TM3 [0,1,0,0,0,0|2,0,0]=3 2231 B11R1.167 Nc1ccc(c(c1)C(=O)N)F 1P00DI2I [0,1,0,0,0,0|2,0,0]=3 2232 B11R1.167 Nc1ccc(c(c1)C(=O)O)Br 1P00BD5V [0,1,0,0,0,0|1,0,0]=2 2233 B11R1.167 Nc1ccc(c(c1)C(=O)O)C 1P00I5SH [0,1,0,0,0,0|1,0,0]=2 2234 B11R1.167 Nc1ccc(c(c1)C(=O)O)Cl 1P003MTU [0,1,0,0,0,0|1,0,0]=2 2235 B11R1.167 Nc1ccc(c(c1)C(=O)O)F 1P003MTY [0,1,0,0,0,0|1,0,0]=2 2236 B11R1.167 Nc1ccc(c(c1)C(=O)O)I 1P01OZIP [0,1,0,0,0,0|1,0,0]=2 2237 B11R1.167 Nc1ccc(c(c1)C(=O)O)N 1P000HE0 [0,1,0,0,0,0|1,0,0]=2 2238 B11R1.167 Nc1ccc(c(c1)C(=O)O)N 1P00E9JO [0,1,0,0,0,0|1,0,0]=2 2239 B11R1.167 Nc1ccc(c(c1)C(=O)O)O 1P003MVD [0,1,0,0,0,0|0,0,0]=1 2240 B11R1.167 Nc1ccc(c(c1)C(=O)[O-])O 1P003US4 [0,1,0,0,0,0|0,0,1]=2 2241 B11R1.167 Nc1ccc(c(c1)C(C)C)O 1P00ALVM [0,1,0,0,0,0|2,0,1]=4 2242 B11R1.167 Nc1ccc(c(c1)C(O)C)F 1P001MXR [0,1,0,0,0,0|2,0,1]=4 2243 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])Br 1P0034EH [0,1,0,0,0,0|2,0,1]=4 2244 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])C 1P0081ZD [0,1,0,0,0,0|2,0,1]=4 2245 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])Cl 1P003LLS [0,1,0,0,0,0|2,0,1]=4 2246 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])F 1P003LV4 [0,1,0,0,0,0|2,0,1]=4 2247 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])I 1P003M12 [0,1,0,0,0,0|2,0,1]=4 2248 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])N 1P00I9XT [0,1,0,0,0,0|2,0,1]=4 2249 B11R1.167 Nc1ccc(c(c1)[N+](=O)[O-])O 1P003L5G [0,1,0,0,0,0|1,0,1]=3 2250 B11R1.167 Nc1ccc(c(n1)C(=O)O)Br 1P007YAZ [0,1,0,0,0,0|2,0,0]=3 2251 B11R1.167 Nc1ccc(c(n1)C(=O)O)C 1P021ZDU [0,1,0,0,0,0|2,0,0]=3 2252 B11R1.167 Nc1cnc(c(c1)C(=O)N)C 1P019RI1 [0,1,0,0,0,0|3,0,0]=4 2253 B11R1.167 Nc1cnc(c(c1)C(=O)O)Br 1P028XEX [0,1,0,0,0,0|2,0,0]=3 2254 B11R1.167 Nc1cnc(c(c1)C(=O)O)C 1P007BS0 [0,1,0,0,0,0|2,0,0]=3 2255 B11R1.167 Nc1cnc(c(c1)C(=O)O)Cl 1P0070QT [0,1,0,0,0,0|2,0,0]=3 2256 B11R1.167 Nc1ncc(c(c1)C(=O)O)Br 1P0000TD [0,1,0,0,0,0|2,0,0]=3 2257 B11R1.167 Nc1ncc(c(c1)C(=O)O)F 1P000RHQ [0,1,0,0,0,0|2,0,0]=3 2258 B11R1.167 Nc1ncc(c(n1)C(=O)O)Br 1P00GYXK [0,1,0,0,0,0|3,0,0]=4 2259 B11R1.167 Nc1ncc(c(n1)C(=O)O)Cl 1P001RE7 [0,1,0,0,0,0|3,0,0]=4 2260 B11R1.167 Nc1ncc(c(n1)C(=O)O)Cl 1P00DCGV [0,1,0,0,0,0|3,0,0]=4 2261 B11R1.167 O=C1CC=C(C(=N1)C(=O)O)Cl 1P000T1K [0,1,0,0,0,0|2,0,1]=4 2262 B11R1.167 O=c1ccn(c(c1)C(=O)O)C 1P01DV28 [0,1,0,0,0,0|2,0,0]=3 2263 B11R1.167 OC(=O)c1[nH]c(=O)ccc1N 1P01SB0E [0,1,0,0,0,0|2,0,0]=3 2264 B11R1.167 OC(=O)c1cc(=O)[nH]nc1Cl 1P01IKFP [0,1,0,0,0,0|3,0,0]=4 2265 B11R1.167 Oc1ccc(c(c1)B(O)O)C 1P0013XE [0,1,0,0,0,0|2,0,1]=4 2266 B11R1.167 Oc1ccc(c(c1)B(O)O)Cl 1P006O15 [0,1,0,0,0,0|2,0,1]=4 2267 B11R1.167 Oc1ccc(c(c1)B(O)O)F 1P000G3D [0,1,0,0,0,0|2,0,1]=4 2268 B11R1.167 Oc1ccc(c(c1)C(=O)C)Br 1P0094JS [0,1,0,0,0,0|2,0,0]=3 2269 B11R1.167 Oc1ccc(c(c1)C(=O)C)C 1P0075H7 [0,1,0,0,0,0|2,0,0]=3 2270 B11R1.167 Oc1ccc(c(c1)C(=O)C)Cl 1P00IASK [0,1,0,0,0,0|2,0,0]=3 2271 B11R1.167 Oc1ccc(c(c1)C(=O)C)F 1P001L93 [0,1,0,0,0,0|2,0,0]=3 2272 B11R1.167 Oc1ccc(c(c1)C(=O)C)N 1P00327Z [0,1,0,0,0,0|2,0,0]=3 2273 B11R1.167 Oc1ccc(c(c1)C(=O)C)O 1P0033H2 [0,1,0,0,0,0|1,0,0]=2 2274 B11R1.167 Oc1ccc(c(c1)C(=O)N)C 1P009DJ0 [0,1,0,0,0,0|2,0,0]=3 2275 B11R1.167 Oc1ccc(c(c1)C(=O)O)Br 1P00ED7I [0,1,0,0,0,0|1,0,0]=2 2276 B11R1.167 Oc1ccc(c(c1)C(=O)O)C 1P003935 [0,1,0,0,0,0|1,0,0]=2 2277 B11R1.167 Oc1ccc(c(c1)C(=O)O)Cl 1P003HFL [0,1,0,0,0,0|1,0,0]=2 2278 B11R1.167 Oc1ccc(c(c1)C(=O)O)F 1P003HQU [0,1,0,0,0,0|1,0,0]=2 2279 B11R1.167 Oc1ccc(c(c1)C(=O)O)I 1P00EJ2U [0,1,0,0,0,0|1,0,0]=2 2280 B11R1.167 Oc1ccc(c(c1)C(=O)O)N 1P0034QY [0,1,0,0,0,0|1,0,0]=2 2281 B11R1.167 Oc1ccc(c(c1)C(=O)O)O 1P003R7I [0,1,0,0,0,0|0,0,0]=1 2282 B11R1.167 Oc1ccc(c(c1)C(=O)O)O 1P006K3G [0,1,0,0,0,0|0,0,0]=1 2283 B11R1.167 Oc1ccc(c(c1)C(=O)[O-])O 1P003URD [0,1,0,0,0,0|0,0,1]=2 2284 B11R1.167 Oc1ccc(c(c1)C(C)C)O 1P002NUT [0,1,0,0,0,0|2,0,1]=4 2285 B11R1.167 Oc1ccc(c(c1)C(N)C)O 1P028CT5 [0,1,0,0,0,0|2,0,1]=4 2286 B11R1.167 Oc1ccc(c(c1)N(C)C)O 1P021ZAQ [0,1,0,0,0,0|3,0,0]=4 2287 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])Br 1P008NYT [0,1,0,0,0,0|2,0,1]=4 2288 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])C 1P0029SX [0,1,0,0,0,0|2,0,1]=4 2289 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])Cl 1P00IB8Z [0,1,0,0,0,0|2,0,1]=4 2290 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])F 1P002LB1 [0,1,0,0,0,0|2,0,1]=4 2291 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])I 1P003M14 [0,1,0,0,0,0|2,0,1]=4 2292 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])N 1P00IB90 [0,1,0,0,0,0|2,0,1]=4 2293 B11R1.167 Oc1ccc(c(c1)[N+](=O)[O-])O 1P001VXN [0,1,0,0,0,0|1,0,1]=3 2294 B11R1.167 Oc1ccc(c(n1)C(=O)O)F 1P00IB64 [0,1,0,0,0,0|2,0,0]=3 2295 B11R1.167 Oc1cnc(c(c1)C(=O)O)Cl 1P00CM2Q [0,1,0,0,0,0|2,0,0]=3 2296 B11R1.167 Oc1cnc(c(c1)C(=O)O)N 1P01B303 [0,1,0,0,0,0|2,0,0]=3 2297 B11R1.167 Oc1cnc(c(c1)C(=O)O)N 1P01B4FE [0,1,0,0,0,0|2,0,0]=3 2298 B11R1.167 Oc1ncc(c(c1)C(=O)O)Br 1P006NPA [0,1,0,0,0,0|2,0,0]=3 2299 B11R1.167 Oc1ncc(c(c1)C(=O)O)C 1P019T98 [0,1,0,0,0,0|2,0,0]=3 2300 B11R1.167 Oc1ncc(c(c1)C(=O)O)F 1P0290RV [0,1,0,0,0,0|2,0,0]=3 2301 B11R1.167 Sc1ccc(c(c1)C(=O)O)Br 1P01A60P [0,1,0,0,0,0|1,0,0]=2 2302 B11R1.167 [O-][n+]1ccc(c(c1)[N+](=O)[O-])O 1P003LYZ [0,1,0,0,0,0|2,0,1]=4 2303 B11R1.167 [O-][n+]1ccc(cc1C(=O)O)Cl 1P01HW5G [0,1,0,0,0,0|1,0,1]=3 2304 B11R1.222 BrCC(=O)c1ccc[nH]c1=O 1P00BU7Z [0,1,0,0,0,0|2,0,1]=4 2305 B11R1.222 BrCC(=O)c1ccccc1Br 1P00DAWM [0,1,0,0,0,0|2,0,0]=3 2306 B11R1.222 BrCC(=O)c1ccccc1C 1P00DEAM [0,1,0,0,0,0|2,0,0]=3 2307 B11R1.222 BrCC(=O)c1ccccc1Cl 1P003H2D [0,1,0,0,0,0|2,0,0]=3 2308 B11R1.222 BrCC(=O)c1ccccc1F 1P003H2Z [0,1,0,0,0,0|2,0,0]=3 2309 B11R1.222 BrCC(=O)c1ccccc1O 1P002QB5 [0,1,0,0,0,0|1,0,0]=2 2310 B11R1.222 BrCC(=O)c1ccncc1Br 1P01DYXL [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.222 BrCC(=O)c1ccncc1Cl 1P00972Q [0,1,0,0,0,0|3,0,0]=4 2312 B11R1.222 BrCC(=O)c1ccncc1F 1P01AUWL [0,1,0,0,0,0|3,0,0]=4 2313 B11R1.222 BrC[C@H](c1ccccc1Cl)O 1P019VDV [0,1,0,0,0,0|2,0,1]=4 2314 B11R1.222 C#CC(=O)c1ccccc1Br 1P01P4JR [0,1,0,0,0,0|2,0,0]=3 2315 B11R1.222 C#CC(=O)c1ccccc1Cl 1P01JMOK [0,1,0,0,0,0|2,0,0]=3 2316 B11R1.222 C#CC(c1ccccc1Cl)O 1P002FJN [0,1,0,0,0,0|2,0,1]=4 2317 B11R1.222 C(=O)(CC)c1c(Br)cccn1 1P01FWJT [0,1,0,0,0,0|3,0,0]=4 2318 B11R1.222 C=CC(=O)c1ccccc1F 1P003WYY [0,1,0,0,0,0|2,0,0]=3 2319 B11R1.222 C=CC(c1ccccc1F)O 1P02915W [0,1,0,0,0,0|2,0,1]=4 2320 B11R1.222 CCC(=O)c1ccccc1Br 1P00EK76 [0,1,0,0,0,0|2,0,0]=3 2321 B11R1.222 CCC(=O)c1ccccc1C 1P0029P4 [0,1,0,0,0,0|2,0,0]=3 2322 B11R1.222 CCC(=O)c1ccccc1Cl 1P00EB73 [0,1,0,0,0,0|2,0,0]=3 2323 B11R1.222 CCC(=O)c1ccccc1F 1P003DB2 [0,1,0,0,0,0|2,0,0]=3 2324 B11R1.222 CCC(=O)c1ccccc1N 1P000PPD [0,1,0,0,0,0|2,0,0]=3 2325 B11R1.222 CCC(=O)c1ccccc1O 1P003BP5 [0,1,0,0,0,0|1,0,0]=2 2326 B11R1.222 CCC(=O)c1cnccc1N 1P01A5EL [0,1,0,0,0,0|3,0,0]=4 2327 B11R1.222 CCC(=O)c1cnccc1N 1P028XZG [0,1,0,0,0,0|3,0,0]=4 2328 B11R1.222 CCC(=O)c1ncccc1C 1P00IHC7 [0,1,0,0,0,0|3,0,0]=4 2329 B11R1.222 CCC(c1ccccc1Br)O 1P00FH1T [0,1,0,0,0,0|2,0,1]=4 2330 B11R1.222 CCC(c1ccccc1O)C 1P0042T9 [0,1,0,0,0,0|2,0,1]=4 2331 B11R1.222 CCC(c1ccccc1O)N 1P01AHNC [0,1,0,0,0,0|2,0,1]=4 2332 B11R1.222 CCS(=O)c1ccccc1N 1P019SID [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.222 CC[C@@H](c1ccccc1O)N 1P00A0AB [0,1,0,0,0,0|2,0,1]=4 2334 B11R1.222 CNC(=N)c1ccccc1Cl 1P01BA7J [0,1,0,0,0,0|3,0,0]=4 2335 B11R1.222 CNC(=O)c1c[nH]ccc1=O 1P003SNT [0,1,0,0,0,0|2,0,1]=4 2336 B11R1.222 CNC(=O)c1ccccc1Br 1P00EAJD [0,1,0,0,0,0|2,0,0]=3 2337 B11R1.222 CNC(=O)c1ccccc1Cl 1P007ICE [0,1,0,0,0,0|2,0,0]=3 2338 B11R1.222 CNC(=O)c1ccccc1F 1P00DJ9S [0,1,0,0,0,0|2,0,0]=3 2339 B11R1.222 CNC(=O)c1ccccc1I 1P00IASP [0,1,0,0,0,0|2,0,0]=3 2340 B11R1.222 CNC(=O)c1ccccc1N 1P003H0C [0,1,0,0,0,0|2,0,0]=3 2341 B11R1.222 CNC(=O)c1ccccc1O 1P00AC9J [0,1,0,0,0,0|1,0,0]=2 2342 B11R1.222 CNC(=O)c1ccccc1S 1P002DAW [0,1,0,0,0,0|1,1,0]=3 2343 B11R1.222 CNC(=O)c1cccnc1Cl 1P00DJ9W [0,1,0,0,0,0|3,0,0]=4 2344 B11R1.222 CNC(=O)c1cccnc1N 1P004VCL [0,1,0,0,0,0|3,0,0]=4 2345 B11R1.222 CNC(=O)c1ccncc1N 1P01XD5J [0,1,0,0,0,0|3,0,0]=4 2346 B11R1.222 CNC(=O)c1cnccc1N 1P00H57Q [0,1,0,0,0,0|3,0,0]=4 2347 B11R1.222 CNC(=O)c1ncccc1F 1P01KLCK [0,1,0,0,0,0|3,0,0]=4 2348 B11R1.222 CNC(=O)c1ncccc1O 1P000PPB [0,1,0,0,0,0|2,0,0]=3 2349 B11R1.222 CNC(c1ccccc1O)C 1P0096TK [0,1,0,0,0,0|2,0,1]=4 2350 B11R1.222 CNC(c1ccccc1O)C 1P019LPL [0,1,0,0,0,0|2,0,1]=4 2351 B11R1.222 COC(=O)C1N=CC=CC1=N 1P00ADH1 [0,1,0,0,0,0|2,0,1]=4 2352 B11R1.222 COC(=O)c1c[nH]ccc1=O 1P00FZ4E [0,1,0,0,0,0|1,0,1]=3 2353 B11R1.222 COC(=O)c1ccc[nH]c1=O 1P0004LA [0,1,0,0,0,0|1,0,1]=3 2354 B11R1.222 COC(=O)c1ccc[nH]c1=S 1P005BW3 [0,1,0,0,0,0|1,1,0]=3 2355 B11R1.222 COC(=O)c1ccccc1Br 1P0035MK [0,1,0,0,0,0|1,0,0]=2 2356 B11R1.222 COC(=O)c1ccccc1C 1P0036QP [0,1,0,0,0,0|1,0,0]=2 2357 B11R1.222 COC(=O)c1ccccc1Cl 1P003S46 [0,1,0,0,0,0|1,0,0]=2 2358 B11R1.222 COC(=O)c1ccccc1F 1P00I87W [0,1,0,0,0,0|1,0,0]=2 2359 B11R1.222 COC(=O)c1ccccc1I 1P0033TT [0,1,0,0,0,0|1,0,0]=2 2360 B11R1.222 COC(=O)c1ccccc1N 1P0035P7 [0,1,0,0,0,0|1,0,0]=2 2361 B11R1.222 COC(=O)c1ccccc1O 1P003SJ9 [0,1,0,0,0,0|0,0,0]=1 2362 B11R1.222 COC(=O)c1ccccc1S 1P0035PV [0,1,0,0,0,0|0,1,0]=2 2363 B11R1.222 COC(=O)c1cccnc1Br 1P00I9W4 [0,1,0,0,0,0|2,0,0]=3 2364 B11R1.222 COC(=O)c1cccnc1Cl 1P003S49 [0,1,0,0,0,0|2,0,0]=3 2365 B11R1.222 COC(=O)c1cccnc1F 1P00I8WP [0,1,0,0,0,0|2,0,0]=3 2366 B11R1.222 COC(=O)c1cccnc1N 1P001EOQ [0,1,0,0,0,0|2,0,0]=3 2367 B11R1.222 COC(=O)c1cccnc1O 1P0037A5 [0,1,0,0,0,0|1,0,0]=2 2368 B11R1.222 COC(=O)c1cccoc1=O 1P002RRT [0,1,0,0,0,0|1,0,1]=3 2369 B11R1.222 COC(=O)c1ccn[nH]c1=O 1P003WOT [0,1,0,0,0,0|2,0,1]=4 2370 B11R1.222 COC(=O)c1ccncc1Br 1P00392F [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.222 COC(=O)c1ccncc1C 1P000DX7 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.222 COC(=O)c1ccncc1Cl 1P005W3M [0,1,0,0,0,0|2,0,0]=3 2373 B11R1.222 COC(=O)c1ccncc1F 1P00H03J [0,1,0,0,0,0|2,0,0]=3 2374 B11R1.222 COC(=O)c1ccncc1I 1P002HKX [0,1,0,0,0,0|2,0,0]=3 2375 B11R1.222 COC(=O)c1ccncc1N 1P003423 [0,1,0,0,0,0|2,0,0]=3 2376 B11R1.222 COC(=O)c1ccncc1O 1P0004LC [0,1,0,0,0,0|1,0,0]=2 2377 B11R1.222 COC(=O)c1ccncc1O 1P01BFLN [0,1,0,0,0,0|1,0,0]=2 2378 B11R1.222 COC(=O)c1ccnnc1Cl 1P01Z9OO [0,1,0,0,0,0|3,0,0]=4 2379 B11R1.222 COC(=O)c1ccnnc1N 1P000OQZ [0,1,0,0,0,0|3,0,0]=4 2380 B11R1.222 COC(=O)c1cnccc1Br 1P007YLN [0,1,0,0,0,0|2,0,0]=3 2381 B11R1.222 COC(=O)c1cnccc1Br 1P01DDZN [0,1,0,0,0,0|2,0,0]=3 2382 B11R1.222 COC(=O)c1cnccc1Cl 1P006ZTR [0,1,0,0,0,0|2,0,0]=3 2383 B11R1.222 COC(=O)c1cnccc1F 1P0015DS [0,1,0,0,0,0|2,0,0]=3 2384 B11R1.222 COC(=O)c1cnccc1N 1P001SUN [0,1,0,0,0,0|2,0,0]=3 2385 B11R1.222 COC(=O)c1cnccc1O 1P00FAQW [0,1,0,0,0,0|1,0,0]=2 2386 B11R1.222 COC(=O)c1cnccc1S 1P028YCW [0,1,0,0,0,0|1,1,0]=3 2387 B11R1.222 COC(=O)c1cncnc1C 1P00AMKM [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.222 COC(=O)c1cncnc1Cl 1P000MZ9 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.222 COC(=O)c1cncnc1N 1P00670W [0,1,0,0,0,0|3,0,0]=4 2390 B11R1.222 COC(=O)c1cncnc1O 1P0038AC [0,1,0,0,0,0|2,0,0]=3 2391 B11R1.222 COC(=O)c1cnncc1N 1P028U4I [0,1,0,0,0,0|3,0,0]=4 2392 B11R1.222 COC(=O)c1cnncc1O 1P01Q4UN [0,1,0,0,0,0|2,0,0]=3 2393 B11R1.222 COC(=O)c1ncc[nH]c1=O 1P002VB9 [0,1,0,0,0,0|2,0,1]=4 2394 B11R1.222 COC(=O)c1ncccc1Br 1P0035NC [0,1,0,0,0,0|2,0,0]=3 2395 B11R1.222 COC(=O)c1ncccc1C 1P003S9R [0,1,0,0,0,0|2,0,0]=3 2396 B11R1.222 COC(=O)c1ncccc1C 1P00HVC1 [0,1,0,0,0,0|2,0,0]=3 2397 B11R1.222 COC(=O)c1ncccc1Cl 1P000CU1 [0,1,0,0,0,0|2,0,0]=3 2398 B11R1.222 COC(=O)c1ncccc1F 1P0035NK [0,1,0,0,0,0|2,0,0]=3 2399 B11R1.222 COC(=O)c1ncccc1I 1P0038X7 [0,1,0,0,0,0|2,0,0]=3 2400 B11R1.222 COC(=O)c1ncccc1N 1P0035NA [0,1,0,0,0,0|2,0,0]=3 2401 B11R1.222 COC(=O)c1ncccc1O 1P0037MQ [0,1,0,0,0,0|1,0,0]=2 2402 B11R1.222 COC(=O)c1nccnc1Br 1P0035NE [0,1,0,0,0,0|3,0,0]=4 2403 B11R1.222 COC(=O)c1nccnc1Cl 1P002VB8 [0,1,0,0,0,0|3,0,0]=4 2404 B11R1.222 COC(=O)c1nccnc1F 1P000S9J [0,1,0,0,0,0|3,0,0]=4 2405 B11R1.222 COC(=O)c1nccnc1I 1P001Z7M [0,1,0,0,0,0|3,0,0]=4 2406 B11R1.222 COC(=O)c1nccnc1N 1P001U23 [0,1,0,0,0,0|3,0,0]=4 2407 B11R1.222 COC(=O)c1ncncc1Br 1P0003U0 [0,1,0,0,0,0|3,0,0]=4 2408 B11R1.222 COC(=O)c1ncncc1C 1P021LAO [0,1,0,0,0,0|3,0,0]=4 2409 B11R1.222 COC(=O)c1ncncc1Cl 1P000NEX [0,1,0,0,0,0|3,0,0]=4 2410 B11R1.222 COC(=O)c1ncncc1F 1P028CB1 [0,1,0,0,0,0|3,0,0]=4 2411 B11R1.222 COC(=O)c1ncncc1N 1P01JUGJ [0,1,0,0,0,0|3,0,0]=4 2412 B11R1.222 COC(c1ccccc1Br)C 1P0283AX [0,1,0,0,0,0|2,0,1]=4 2413 B11R1.222 Cc1ccncc1C(=C)CO 1P028FJU [0,1,0,0,0,0|3,0,0]=4 2414 B11R1.222 Cc1ccncc1C(=O)CBr 1P028ZS9 [0,1,0,0,0,0|3,0,0]=4 2415 B11R1.222 Cc1ccncc1C(=O)OC 1P00BZYE [0,1,0,0,0,0|2,0,0]=3 2416 B11R1.222 Cc1ccnnc1C(=O)OC 1P01P5OJ [0,1,0,0,0,0|3,0,0]=4 2417 B11R1.222 Cc1cnncc1C(=O)OC 1P00127C [0,1,0,0,0,0|3,0,0]=4 2418 B11R1.222 Cc1ncccc1C(=O)CBr 1P00EIIO [0,1,0,0,0,0|3,0,0]=4 2419 B11R1.222 Cc1ncccc1C(=O)CBr 1P01ANK5 [0,1,0,0,0,0|3,0,0]=4 2420 B11R1.222 Cc1ncccc1C(=O)NN 1P007RJ6 [0,1,0,0,0,0|3,0,0]=4 2421 B11R1.222 Cc1ncccc1C(=O)OC 1P003S5I [0,1,0,0,0,0|2,0,0]=3 2422 B11R1.222 Cc1nccnc1C(=O)OC 1P00C7EX [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.222 ClCC(=O)c1ccccc1Cl 1P01A092 [0,1,0,0,0,0|2,0,0]=3 2424 B11R1.222 ClCC(=O)c1ccccc1F 1P00DE1J [0,1,0,0,0,0|2,0,0]=3 2425 B11R1.222 ClCC(=O)c1ccncc1F 1P028GD7 [0,1,0,0,0,0|3,0,0]=4 2426 B11R1.222 ClCC(=O)c1ncccc1F 1P00A0JC [0,1,0,0,0,0|3,0,0]=4 2427 B11R1.222 FCC(=O)c1ccccc1Br 1P009XTQ [0,1,0,0,0,0|2,0,0]=3 2428 B11R1.222 FCC(=O)c1ccccc1C 1P01DW8K [0,1,0,0,0,0|2,0,0]=3 2429 B11R1.222 FCC(=O)c1ccccc1F 1P001CNY [0,1,0,0,0,0|2,0,0]=3 2430 B11R1.222 FCC(=O)c1cccnc1Cl 1P027VJE [0,1,0,0,0,0|3,0,0]=4 2431 B11R1.222 FCC(c1ccccc1Br)O 1P0288PA [0,1,0,0,0,0|2,0,1]=4 2432 B11R1.222 FCC(c1ccccc1C)O 1P01DW8V [0,1,0,0,0,0|2,0,1]=4 2433 B11R1.222 FCC(c1ccccc1F)O 1P0290K8 [0,1,0,0,0,0|2,0,1]=4 2434 B11R1.222 FC[C@H](c1ccccc1F)O 1P0291DI [0,1,0,0,0,0|2,0,1]=4 2435 B11R1.222 N#CC(=O)c1ccccc1C 1P00EA75 [0,1,0,0,0,0|2,0,0]=3 2436 B11R1.222 N#CC(=O)c1ccccc1Cl 1P00BYZS [0,1,0,0,0,0|2,0,0]=3 2437 B11R1.222 N#CC(=O)c1ccccc1F 1P008NJP [0,1,0,0,0,0|2,0,0]=3 2438 B11R1.222 N#CC(c1ccccc1Cl)O 1P0014SE [0,1,0,0,0,0|2,0,1]=4 2439 B11R1.222 N#CC(c1ccccc1O)O 1P028G7U [0,1,0,0,0,0|1,0,1]=3 2440 B11R1.222 NC(=C1C=CC=NC1=O)NO 1P01A8D7 [0,1,0,0,0,0|2,0,1]=4 2441 B11R1.222 NCC(=C)c1ccccc1F 1P028BXM [0,1,0,0,0,0|3,0,0]=4 2442 B11R1.222 NCC(=O)c1ccccc1Br 1P01ALG9 [0,1,0,0,0,0|2,0,0]=3 2443 B11R1.222 NCC(=O)c1ccccc1C 1P00FC2T [0,1,0,0,0,0|2,0,0]=3 2444 B11R1.222 NCC(=O)c1ccccc1Cl 1P00AR76 [0,1,0,0,0,0|2,0,0]=3 2445 B11R1.222 NCC(=O)c1ccccc1F 1P00GW1J [0,1,0,0,0,0|2,0,0]=3 2446 B11R1.222 NCC(=O)c1ccccc1O 1P01C4S3 [0,1,0,0,0,0|1,0,0]=2 2447 B11R1.222 NCC(=O)c1cccnc1Cl 1P01BSJV [0,1,0,0,0,0|3,0,0]=4 2448 B11R1.222 NCC(=O)c1ncccc1Cl 1P01BS15 [0,1,0,0,0,0|3,0,0]=4 2449 B11R1.222 NCC(c1ccccc1Br)O 1P00FC1G [0,1,0,0,0,0|2,0,1]=4 2450 B11R1.222 NCC(c1ccccc1C)O 1P01AI84 [0,1,0,0,0,0|2,0,1]=4 2451 B11R1.222 NCC(c1ccccc1Cl)O 1P00BL9B [0,1,0,0,0,0|2,0,1]=4 2452 B11R1.222 NCC(c1ccccc1Cl)O 1P00I8F7 [0,1,0,0,0,0|2,0,1]=4 2453 B11R1.222 NCC(c1ccccc1F)O 1P003GSL [0,1,0,0,0,0|2,0,1]=4 2454 B11R1.222 NCC(c1ccccc1O)O 1P00BVOK [0,1,0,0,0,0|1,0,1]=3 2455 B11R1.222 NNC(=O)c1ccccc1C 1P008QFS [0,1,0,0,0,0|2,0,0]=3 2456 B11R1.222 NNC(=O)c1ccccc1Cl 1P003HIC [0,1,0,0,0,0|2,0,0]=3 2457 B11R1.222 NNC(=O)c1ccccc1F 1P003HS4 [0,1,0,0,0,0|2,0,0]=3 2458 B11R1.222 NNC(=O)c1ccccc1F 1P01BGFD [0,1,0,0,0,0|2,0,0]=3 2459 B11R1.222 NNC(=O)c1ccccc1I 1P00BZLS [0,1,0,0,0,0|2,0,0]=3 2460 B11R1.222 NNC(=O)c1ccccc1N 1P002F0J [0,1,0,0,0,0|2,0,0]=3 2461 B11R1.222 NNC(=O)c1ccccc1O 1P003UND [0,1,0,0,0,0|1,0,0]=2 2462 B11R1.222 NNC(=O)c1ccncc1C 1P0024WL [0,1,0,0,0,0|3,0,0]=4 2463 B11R1.222 NNC(=O)c1ccncc1Cl 1P01A7FE [0,1,0,0,0,0|3,0,0]=4 2464 B11R1.222 NNC(=O)c1ccncc1F 1P01ACMI [0,1,0,0,0,0|3,0,0]=4 2465 B11R1.222 NNC(=O)c1ccncc1N 1P00EE8K [0,1,0,0,0,0|3,0,0]=4 2466 B11R1.222 NNC(=O)c1ncccc1C 1P01A2HW [0,1,0,0,0,0|3,0,0]=4 2467 B11R1.222 N\C(=N/O)\c1cccnc1Cl 1P00DQWH [0,1,0,0,0,0|3,0,0]=4 2468 B11R1.222 Nc1ccncc1C(=O)NN 1P003ZHR [0,1,0,0,0,0|3,0,0]=4 2469 B11R1.222 Nc1ncccc1C(=O)NN 1P00E17H [0,1,0,0,0,0|3,0,0]=4 2470 B11R1.222 O=CC(=O)c1ccccc1Br 1P01B92D [0,1,0,0,0,0|1,0,1]=3 2471 B11R1.222 O=CC(=O)c1ccccc1C 1P00EJ1Q [0,1,0,0,0,0|1,0,1]=3 2472 B11R1.222 O=CC(=O)c1ccccc1C 1P01XC2I [0,1,0,0,0,0|1,0,1]=3 2473 B11R1.222 O=CC(c1ccccc1Br)C 1P0288HD [0,1,0,0,0,0|2,0,1]=4 2474 B11R1.222 O=CC(c1ccccc1C)C 1P028W93 [0,1,0,0,0,0|2,0,1]=4 2475 B11R1.222 O=CC(c1ccccc1Cl)C 1P02892X [0,1,0,0,0,0|2,0,1]=4 2476 B11R1.222 O=CC(c1ccccc1F)C 1P024Q0P [0,1,0,0,0,0|2,0,1]=4 2477 B11R1.222 O=CC(c1ccccc1I)C 1P028ELW [0,1,0,0,0,0|2,0,1]=4 2478 B11R1.222 O=CN(c1ccccc1C)C 1P0010A4 [0,1,0,0,0,0|3,0,0]=4 2479 B11R1.222 O=NN(c1ccccc1Cl)C 1P02856H [0,1,0,0,0,0|3,0,0]=4 2480 B11R1.222 O=NN(c1ccccc1F)C 1P0281G6 [0,1,0,0,0,0|3,0,0]=4 2481 B11R1.222 OCC(=C)c1ccccc1C 1P027Y44 [0,1,0,0,0,0|2,0,0]=3 2482 B11R1.222 OCC(=O)c1ccccc1Br 1P01DFAD [0,1,0,0,0,0|1,0,0]=2 2483 B11R1.222 OCC(=O)c1ccccc1Cl 1P003GQ7 [0,1,0,0,0,0|1,0,0]=2 2484 B11R1.222 OCC(c1ccccc1Br)N 1P0096SU [0,1,0,0,0,0|2,0,1]=4 2485 B11R1.222 OCC(c1ccccc1C)N 1P0096QK [0,1,0,0,0,0|2,0,1]=4 2486 B11R1.222 OCC(c1ccccc1C)N 1P024G0J [0,1,0,0,0,0|2,0,1]=4 2487 B11R1.222 OCC(c1ccccc1Cl)N 1P000XJ8 [0,1,0,0,0,0|2,0,1]=4 2488 B11R1.222 OCC(c1ccccc1Cl)N 1P01WTOO [0,1,0,0,0,0|2,0,1]=4 2489 B11R1.222 OCC(c1ccccc1F)N 1P0027R2 [0,1,0,0,0,0|2,0,1]=4 2490 B11R1.222 OCC(c1ccccc1F)N 1P01AJ3A [0,1,0,0,0,0|2,0,1]=4 2491 B11R1.222 OCC(c1ccccc1I)N 1P01EMYZ [0,1,0,0,0,0|2,0,1]=4 2492 B11R1.222 OC[C@@H](c1ccccc1Br)N 1P01BINE [0,1,0,0,0,0|2,0,1]=4 2493 B11R1.222 OC[C@@H](c1ccccc1Br)N 1P01JV4Y [0,1,0,0,0,0|2,0,1]=4 2494 B11R1.222 OC[C@@H](c1ccccc1C)N 1P01KL5C [0,1,0,0,0,0|2,0,1]=4 2495 B11R1.222 OC[C@@H](c1ccccc1F)N 1P01EC5J [0,1,0,0,0,0|2,0,1]=4 2496 B11R1.222 OC[C@@H](c1ccccc1F)N 1P01K0OD [0,1,0,0,0,0|2,0,1]=4 2497 B11R1.222 OC[C@H](c1ccccc1Br)N 1P01JV4G [0,1,0,0,0,0|2,0,1]=4 2498 B11R1.222 OC[C@H](c1ccccc1Br)N 1P01KKYD [0,1,0,0,0,0|2,0,1]=4 2499 B11R1.222 OC[C@H](c1ccccc1C)N 1P01KLCH [0,1,0,0,0,0|2,0,1]=4 2500 B11R1.222 OC[C@H](c1ccccc1Cl)N 1P00BJ0E [0,1,0,0,0,0|2,0,1]=4 2501 B11R1.222 OC[C@H](c1ccccc1Cl)O 1P0014OJ [0,1,0,0,0,0|1,0,2]=4 2502 B11R1.222 OC[C@H](c1ccccc1F)N 1P000WY0 [0,1,0,0,0,0|2,0,1]=4 2503 B11R1.222 OC[C@H](c1ccccc1F)N 1P00C41D [0,1,0,0,0,0|2,0,1]=4 2504 B11R1.222 ON=C(c1ccccc1Cl)Cl 1P002Z8I [0,1,0,0,0,0|2,0,0]=3 2505 B11R1.222 ON=C(c1ccccc1Cl)N 1P00EB6R [0,1,0,0,0,0|2,0,0]=3 2506 B11R1.222 ON=C(c1ccccc1F)C 1P028JDV [0,1,0,0,0,0|2,0,0]=3 2507 B11R1.222 ON=C(c1ccccc1N)N 1P01EKJM [0,1,0,0,0,0|2,0,0]=3 2508 B11R1.222 ON=C(c1ccccc1O)C 1P000PPC [0,1,0,0,0,0|1,0,0]=2 2509 B11R1.222 ON=C(c1ccncc1F)C 1P01B9KH [0,1,0,0,0,0|3,0,0]=4 2510 B11R1.222 ONC(=N)c1ccccc1Br 1P00116I [0,1,0,0,0,0|2,0,0]=3 2511 B11R1.222 ONC(=N)c1ccccc1F 1P01E6LV [0,1,0,0,0,0|2,0,0]=3 2512 B11R1.222 ONC(=N)c1ccccc1N 1P001UME [0,1,0,0,0,0|2,0,0]=3 2513 B11R1.222 ONC(=O)c1ccccc1Br 1P019UXX [0,1,0,0,0,0|1,0,0]=2 2514 B11R1.222 ONC(=O)c1ccccc1O 1P003UNE [0,1,0,0,0,0|0,0,0]=1 2515 B11R1.222 O\N=C(/c1ccccc1O)\C 1P01B9SN [0,1,0,0,0,0|1,0,0]=2 2516 B11R1.222 O\N=C(\c1ccccc1C)/N 1P003I58 [0,1,0,0,0,0|2,0,0]=3 2517 B11R1.222 O\N=C(\c1ccccc1F)/N 1P00G3DH [0,1,0,0,0,0|2,0,0]=3 2518 B9R0.2 C=CC=CC=CCC(=O)C 1P0286AW [0,0,1,0,0,0|2,0,1]=4 2519 B9R0.2 CCC\C=C\C=C\C(=O)O 1P006ZC7 [0,0,1,0,0,0|1,0,2]=4 2520 B9R0.33 C=CCC(C(=O)O)C(=O)O 1P003O76 [0,0,1,0,0,0|1,0,2]=4 2521 B11R2.1 Brc1c[nH]c2c1cccc2 1P001LDH [0,0,0,1,0,0|3,0,0]=4 2522 B11R2.1 Brc1coc2c1cccc2 1P00EAXK [0,0,0,1,0,0|2,0,0]=3 2523 B11R2.1 Brc1coc2c1cccn2 1P006734 [0,0,0,1,0,0|3,0,0]=4 2524 B11R2.1 Brc1coc2c1cncc2 1P006732 [0,0,0,1,0,0|3,0,0]=4 2525 B11R2.1 Brc1coc2c1nccc2 1P006733 [0,0,0,1,0,0|3,0,0]=4 2526 B11R2.1 Brc1csc2c1cccc2 1P003JG3 [0,0,0,1,0,0|2,1,0]=4 2527 B11R2.1 Brc1n[nH]c2c1cccc2 1P003JG4 [0,0,0,1,0,0|3,0,0]=4 2528 B11R2.1 Brc1noc2c1cccc2 1P000T02 [0,0,0,1,0,0|2,0,0]=3 2529 B11R2.1 Brc1noc2c1cccn2 1P00IEK7 [0,0,0,1,0,0|3,0,0]=4 2530 B11R2.1 C=C1CCc2c1cccc2 1P000J6F [0,0,0,1,0,0|3,0,0]=4 2531 B11R2.1 CC1=CCc2c1cccc2 1P005V74 [0,0,0,1,0,0|3,0,0]=4 2532 B11R2.1 CC1COc2c1cccc2 1P008041 [0,0,0,1,0,0|2,0,1]=4 2533 B11R2.1 Cc1[nH]nc2c1cccc2 1P00J2W9 [0,0,0,1,0,0|3,0,0]=4 2534 B11R2.1 Cc1[nH]nc2c1cccc2 1P01B6UF [0,0,0,1,0,0|3,0,0]=4 2535 B11R2.1 Cc1c[nH]c2c1cccc2 1P003K87 [0,0,0,1,0,0|3,0,0]=4 2536 B11R2.1 Cc1coc2c1cccc2 1P003K54 [0,0,0,1,0,0|2,0,0]=3 2537 B11R2.1 Cc1csc2c1cccc2 1P001DL4 [0,0,0,1,0,0|2,1,0]=4 2538 B11R2.1 Cc1n[nH]c2c1cccc2 1P00I6HC [0,0,0,1,0,0|3,0,0]=4 2539 B11R2.1 Cc1noc2c1cccc2 1P00347Z [0,0,0,1,0,0|2,0,0]=3 2540 B11R2.1 Cc1onc2c1cccc2 1P01FM41 [0,0,0,1,0,0|2,0,0]=3 2541 B11R2.1 Clc1c[nH]c2c1cccc2 1P001YOG [0,0,0,1,0,0|3,0,0]=4 2542 B11R2.1 Clc1coc2c1cccc2 1P00EGG5 [0,0,0,1,0,0|2,0,0]=3 2543 B11R2.1 Clc1csc2c1cccc2 1P005EHE [0,0,0,1,0,0|2,1,0]=4 2544 B11R2.1 Clc1n[nH]c2c1cccc2 1P002XU8 [0,0,0,1,0,0|3,0,0]=4 2545 B11R2.1 Clc1noc2c1cccc2 1P007XB7 [0,0,0,1,0,0|2,0,0]=3 2546 B11R2.1 Clc1noc2c1nccc2 1P01FSWC [0,0,0,1,0,0|3,0,0]=4 2547 B11R2.1 Clc1nsc2c1cccc2 1P008O3L [0,0,0,1,0,0|2,1,0]=4 2548 B11R2.1 Clc1snc2c1cccc2 1P00CMJT [0,0,0,1,0,0|2,1,0]=4 2549 B11R2.1 Fc1n[nH]c2c1cccc2 1P006K58 [0,0,0,1,0,0|3,0,0]=4 2550 B11R2.1 Fc1nsc2c1cccc2 1P028RO3 [0,0,0,1,0,0|2,1,0]=4 2551 B11R2.1 Ic1c[nH]c2c1cccc2 1P002TA1 [0,0,0,1,0,0|3,0,0]=4 2552 B11R2.1 Ic1csc2c1cccc2 1P00C7ZR [0,0,0,1,0,0|2,1,0]=4 2553 B11R2.1 Ic1n[nH]c2c1cccc2 1P00H8K8 [0,0,0,1,0,0|3,0,0]=4 2554 B11R2.1 NC1=NCc2c1cccc2 1P003JAG [0,0,0,1,0,0|3,0,0]=4 2555 B11R2.1 NC1=NCc2c1cccc2 1P00G3KS [0,0,0,1,0,0|3,0,0]=4 2556 B11R2.1 NC1COc2c1cccc2 1P003B2V [0,0,0,1,0,0|2,0,1]=4 2557 B11R2.1 N[C@@H]1COc2c1cccc2 1P01B9VO [0,0,0,1,0,0|2,0,1]=4 2558 B11R2.1 N[C@H]1COc2c1cccc2 1P00232H [0,0,0,1,0,0|2,0,1]=4 2559 B11R2.1 Nc1c[nH]c2c1cccc2 1P00EB72 [0,0,0,1,0,0|3,0,0]=4 2560 B11R2.1 Nc1csc2c1cccc2 1P001ZVH [0,0,0,1,0,0|2,1,0]=4 2561 B11R2.1 Nc1csc2c1cccc2 1P00CMAA [0,0,0,1,0,0|2,1,0]=4 2562 B11R2.1 Nc1n[nH]c2c1cccc2 1P003JAF [0,0,0,1,0,0|3,0,0]=4 2563 B11R2.1 Nc1noc2c1cccc2 1P007AWB [0,0,0,1,0,0|2,0,0]=3 2564 B11R2.1 Nc1noc2c1cccn2 1P006KQ7 [0,0,0,1,0,0|3,0,0]=4 2565 B11R2.1 Nc1noc2c1ccnc2 1P000AYX [0,0,0,1,0,0|3,0,0]=4 2566 B11R2.1 Nc1noc2c1cncc2 1P000K8U [0,0,0,1,0,0|3,0,0]=4 2567 B11R2.1 Nc1noc2c1nccc2 1P000AYY [0,0,0,1,0,0|3,0,0]=4 2568 B11R2.1 Nc1nsc2c1cccc2 1P002MFD [0,0,0,1,0,0|2,1,0]=4 2569 B11R2.1 Nc1onc2c1cccc2 1P0028QL [0,0,0,1,0,0|2,0,0]=3 2570 B11R2.1 Nc1snc2c1cccc2 1P00BFPG [0,0,0,1,0,0|2,1,0]=4 2571 B11R2.1 O=C1CCc2c1cccn2 1P00172D [0,0,0,1,0,0|3,0,0]=4 2572 B11R2.1 O=C1CCc2c1cccn2 1P002W77 [0,0,0,1,0,0|3,0,0]=4 2573 B11R2.1 O=C1CCc2c1ccnc2 1P007GGJ [0,0,0,1,0,0|3,0,0]=4 2574 B11R2.1 O=C1CCc2c1cncc2 1P0037KQ [0,0,0,1,0,0|3,0,0]=4 2575 B11R2.1 O=C1CCc2c1nccc2 1P003MQQ [0,0,0,1,0,0|3,0,0]=4 2576 B11R2.1 O=C1CNc2[n+]1cccc2 1P01C68T [0,0,0,1,0,0|3,0,0]=4 2577 B11R2.1 O=C1COc2c1cccc2 1P00345D [0,0,0,1,0,0|1,0,0]=2 2578 B11R2.1 O=C1COc2c1cccn2 1P00BJBI [0,0,0,1,0,0|2,0,0]=3 2579 B11R2.1 O=C1COc2c1ccnc2 1P008YAO [0,0,0,1,0,0|2,0,0]=3 2580 B11R2.1 O=C1CSc2c1cccc2 1P000UBJ [0,0,0,1,0,0|1,1,0]=3 2581 B11R2.1 O=C1NCc2c1cccc2 1P0035II [0,0,0,1,0,0|2,0,0]=3 2582 B11R2.1 O=C1NCc2c1cccn2 1P0034S2 [0,0,0,1,0,0|3,0,0]=4 2583 B11R2.1 O=C1NCc2c1ccnc2 1P00EKI3 [0,0,0,1,0,0|3,0,0]=4 2584 B11R2.1 O=C1NCc2c1cncc2 1P0075NW [0,0,0,1,0,0|3,0,0]=4 2585 B11R2.1 O=C1NCc2c1nccc2 1P009H7O [0,0,0,1,0,0|3,0,0]=4 2586 B11R2.1 O=C1OCc2c1cccc2 1P003U89 [0,0,0,1,0,0|1,0,0]=2 2587 B11R2.1 O=C1OCc2c1cccn2 1P00393G [0,0,0,1,0,0|2,0,0]=3 2588 B11R2.1 O=C1OCc2c1ccnc2 1P00I93W [0,0,0,1,0,0|2,0,0]=3 2589 B11R2.1 O=C1OCc2c1cncc2 1P01C1N0 [0,0,0,1,0,0|2,0,0]=3 2590 B11R2.1 O=C1OCc2c1nccc2 1P00DHC3 [0,0,0,1,0,0|2,0,0]=3 2591 B11R2.1 O=C1SCc2c1cccc2 1P000J6E [0,0,0,1,0,0|1,1,0]=3 2592 B11R2.1 O=c1[nH][nH]c2c1cccc2 1P003K1Q [0,0,0,1,0,0|2,0,0]=3 2593 B11R2.1 O=c1[nH][nH]c2c1cccn2 1P002YSA [0,0,0,1,0,0|3,0,0]=4 2594 B11R2.1 O=c1[nH][nH]c2c1ccnc2 1P00DKUW [0,0,0,1,0,0|3,0,0]=4 2595 B11R2.1 O=c1[nH]cc2n1cccc2 1P01J549 [0,0,0,1,0,0|3,0,0]=4 2596 B11R2.1 O=c1[nH]nc2n1cccc2 1P003BGD [0,0,0,1,0,0|3,0,0]=4 2597 B11R2.1 O=c1[nH]oc2c1cccc2 1P0034YJ [0,0,0,1,0,0|1,0,0]=2 2598 B11R2.1 O=c1[nH]oc2c1cccn2 1P001YSK [0,0,0,1,0,0|2,0,0]=3 2599 B11R2.1 O=c1s[nH]c2c1cccc2 1P018H3I [0,0,0,1,0,0|1,1,0]=3 2600 B11R2.1 O=c1ssc2c1cccc2 1P001Y0I [0,0,0,1,0,0|0,2,0]=3 2601 B11R2.1 OB1OCc2c1cccc2 1P00E9RD [0,0,0,1,0,0|2,0,1]=4 2602 B11R2.1 OC1CCc2c1cccc2 1P003EVW [0,0,0,1,0,0|2,0,1]=4 2603 B11R2.1 OC1COc2c1cccc2 1P01A26G [0,0,0,1,0,0|1,0,1]=3 2604 B11R2.1 OC1COc2c1cccn2 1P001JJ7 [0,0,0,1,0,0|2,0,1]=4 2605 B11R2.1 O[C@@H]1CCc2c1cccc2 1P003CPA [0,0,0,1,0,0|2,0,1]=4 2606 B11R2.1 O[C@@H]1CSc2c1cccc2 1P001YCG [0,0,0,1,0,0|1,1,1]=4 2607 B11R2.1 O[C@H]1CCc2c1cccc2 1P0032WK [0,0,0,1,0,0|2,0,1]=4 2608 B11R2.1 Oc1c[nH]c2c1nccc2 1P01FIBB [0,0,0,1,0,0|3,0,0]=4 2609 B11R2.1 Oc1cnn2c1cccc2 1P01ANNJ [0,0,0,1,0,0|3,0,0]=4 2610 B11R2.1 Oc1csc2c1cccc2 1P003ACX [0,0,0,1,0,0|1,1,0]=3 2611 B11R2.1 Oc1n[nH]c2c1cccc2 1P0003O7 [0,0,0,1,0,0|2,0,0]=3 2612 B11R2.1 Oc1n[nH]c2c1cncc2 1P00CMIK [0,0,0,1,0,0|3,0,0]=4 2613 B11R2.1 Oc1n[nH]c2c1nccc2 1P00DGS9 [0,0,0,1,0,0|3,0,0]=4 2614 B11R2.1 Oc1nnc2n1cccc2 1P0064XZ [0,0,0,1,0,0|3,0,0]=4 2615 B11R2.1 Oc1nsc2c1cccc2 1P00330Y [0,0,0,1,0,0|1,1,0]=3 2616 B11R2.1 Sc1c[nH]c2c1cccc2 1P00I97N [0,0,0,1,0,0|2,1,0]=4 2617 B11R2.1 [O-][n+]1onc2c1cccc2 1P0034YM [0,0,0,1,0,0|2,0,1]=4 2618 B11R2.55 Brc1ccccc1C2CO2 1P00FLU7 [0,0,0,1,0,0|2,0,1]=4 2619 B11R2.55 Clc1ccccc1C2CO2 1P00EC6T [0,0,0,1,0,0|2,0,1]=4 2620 B11R2.55 Clc1ccccc1[C@@H]2CO2 1P01BH98 [0,0,0,1,0,0|2,0,1]=4 2621 B11R2.55 Clc1ccccc1[C@H]2CO2 1P001GT6 [0,0,0,1,0,0|2,0,1]=4 2622 B11R2.55 Fc1ccccc1C2CO2 1P018SD8 [0,0,0,1,0,0|2,0,1]=4 2623 B11R2.55 Oc1ccccc1C2CC2 1P007JIP [0,0,0,1,0,0|2,0,1]=4 2624 B11R2.468 Brc1cccc2c1C(=O)C2 1P01DZPQ [0,0,0,1,0,0|2,0,0]=3 2625 B11R2.468 Clc1cccc2c1C(=O)C2 1P01DT9P [0,0,0,1,0,0|2,0,0]=3 2626 B11R2.468 Fc1cccc2c1C(=O)C2 1P01BRWO [0,0,0,1,0,0|2,0,0]=3 2627 B11R2.845 OC(=O)C1=CC2CC1C=C2 1P0066GL [0,0,0,1,0,0|1,0,2]=4 2628 B9R1.41 CC(=O)c1c[nH]cc1C 1P002H7O [0,0,0,0,1,0|3,0,0]=4 2629 B9R1.41 CC(=O)c1cccn1C 1P003GRG [0,0,0,0,1,0|3,0,0]=4 2630 B9R1.41 CC(=O)c1ccsc1Br 1P0013HS [0,0,0,0,1,0|3,0,0]=4 2631 B9R1.41 CC(=O)c1ccsc1N 1P00H3GS [0,0,0,0,1,0|3,0,0]=4 2632 B9R1.41 CC(=O)c1cscc1Br 1P01AVHJ [0,0,0,0,1,0|3,0,0]=4 2633 B9R1.41 CC(=O)c1cscc1C 1P028JR5 [0,0,0,0,1,0|3,0,0]=4 2634 B9R1.41 CC(=O)c1occc1Br 1P007QLH [0,0,0,0,1,0|3,0,0]=4 2635 B9R1.41 CC(=O)c1occc1C 1P000VSJ [0,0,0,0,1,0|3,0,0]=4 2636 B9R1.41 CC(=O)c1sccc1Br 1P00C0VH [0,0,0,0,1,0|3,0,0]=4 2637 B9R1.41 CC(=O)c1sccc1C 1P0012U9 [0,0,0,0,1,0|3,0,0]=4 2638 B9R1.41 CC(=O)c1sccc1Cl 1P003GRL [0,0,0,0,1,0|3,0,0]=4 2639 B9R1.41 CC(=O)c1sccc1O 1P00DEZ7 [0,0,0,0,1,0|2,0,0]=3 2640 B9R1.41 Cc1c(cc[nH]1)C(=O)O 1P00CJAR [0,0,0,0,1,0|2,0,0]=3 2641 B9R1.41 Cc1c(cn[nH]1)C(=O)O 1P008ZBW [0,0,0,0,1,0|3,0,0]=4 2642 B9R1.41 Cc1c(nc[nH]1)C(=O)O 1P00J3V3 [0,0,0,0,1,0|3,0,0]=4 2643 B9R1.41 Cc1c[nH]cc1C(=O)O 1P00EEYA [0,0,0,0,1,0|2,0,0]=3 2644 B9R1.41 Cc1c[nH]nc1C(=O)O 1P003M98 [0,0,0,0,1,0|3,0,0]=4 2645 B9R1.41 Cc1c[nH]nc1C(=O)O 1P01C25O [0,0,0,0,1,0|3,0,0]=4 2646 B9R1.41 Cc1cnoc1C(=O)O 1P002S9L [0,0,0,0,1,0|3,0,0]=4 2647 B9R1.41 Cc1cnsc1C(=O)O 1P001QUX [0,0,0,0,1,0|3,0,0]=4 2648 B9R1.41 Cc1cocc1C(=O)O 1P00HA4A [0,0,0,0,1,0|2,0,0]=3 2649 B9R1.41 Cc1conc1C(=O)O 1P007QD3 [0,0,0,0,1,0|3,0,0]=4 2650 B9R1.41 Cc1cscc1C(=O)Cl 1P01AD6M [0,0,0,0,1,0|3,0,0]=4 2651 B9R1.41 Cc1cscc1C(=O)O 1P008O79 [0,0,0,0,1,0|2,0,0]=3 2652 B9R1.41 Cc1n[nH]cc1C(=O)O 1P0037YK [0,0,0,0,1,0|3,0,0]=4 2653 B9R1.41 Cc1nc[nH]c1C(=O)O 1P001DSJ [0,0,0,0,1,0|3,0,0]=4 2654 B9R1.41 Cc1ncoc1C(=O)O 1P002QXR [0,0,0,0,1,0|3,0,0]=4 2655 B9R1.41 Cc1ncsc1C(=O)O 1P002A6Z [0,0,0,0,1,0|3,0,0]=4 2656 B9R1.41 Cc1nocc1C(=O)O 1P003481 [0,0,0,0,1,0|3,0,0]=4 2657 B9R1.41 Cc1nscc1C(=O)O 1P001QW4 [0,0,0,0,1,0|3,0,0]=4 2658 B9R1.41 Cc1occc1C(=O)O 1P003I5Y [0,0,0,0,1,0|2,0,0]=3 2659 B9R1.41 Cc1ocnc1C(=O)O 1P003ND2 [0,0,0,0,1,0|3,0,0]=4 2660 B9R1.41 Cc1oncc1C(=O)O 1P003NCC [0,0,0,0,1,0|3,0,0]=4 2661 B9R1.41 Cc1sccc1C(=O)O 1P002FXW [0,0,0,0,1,0|2,0,0]=3 2662 B9R1.41 Cc1scnc1C(=O)O 1P007QWB [0,0,0,0,1,0|3,0,0]=4 2663 B9R1.41 Cc1sncc1C(=O)O 1P01DYW5 [0,0,0,0,1,0|3,0,0]=4 2664 B9R1.41 ClC(=O)c1cscc1Br 1P005EGP [0,0,0,0,1,0|3,0,0]=4 2665 B9R1.41 ClC(=O)c1occc1C 1P007ONW [0,0,0,0,1,0|3,0,0]=4 2666 B9R1.41 ClC(=O)c1sccc1C 1P003K8S [0,0,0,0,1,0|3,0,0]=4 2667 B9R1.41 Cn1cncc1C(=O)O 1P00339D [0,0,0,0,1,0|3,0,0]=4 2668 B9R1.41 Cn1nccc1C(=O)O 1P001SBJ [0,0,0,0,1,0|3,0,0]=4 2669 B9R1.41 FC1=C(NC=C1)C(=O)O 1P01FWZK [0,0,0,0,1,0|2,0,0]=3 2670 B9R1.41 NC(=O)c1c(O)nc[nH]1 1P00E9J7 [0,0,0,0,1,0|3,0,0]=4 2671 B9R1.41 NC(=O)c1cccn1C 1P00EC56 [0,0,0,0,1,0|3,0,0]=4 2672 B9R1.41 NC(=O)c1cccn1N 1P001U6H [0,0,0,0,1,0|3,0,0]=4 2673 B9R1.41 NC(=O)c1cccn1N 1P00APL7 [0,0,0,0,1,0|3,0,0]=4 2674 B9R1.41 NC(=O)c1ccsc1Br 1P002IS4 [0,0,0,0,1,0|3,0,0]=4 2675 B9R1.41 NC(=O)c1ccsc1N 1P001D9F [0,0,0,0,1,0|3,0,0]=4 2676 B9R1.41 NC(=O)c1cscc1Br 1P0001T8 [0,0,0,0,1,0|3,0,0]=4 2677 B9R1.41 NC(=O)c1occc1C 1P01A9MR [0,0,0,0,1,0|3,0,0]=4 2678 B9R1.41 NC(=O)c1sccc1C 1P003K8T [0,0,0,0,1,0|3,0,0]=4 2679 B9R1.41 NC(=O)c1sccc1N 1P001F3L [0,0,0,0,1,0|3,0,0]=4 2680 B9R1.41 Nc1c(cn[nH]1)C(=O)O 1P00A3YG [0,0,0,0,1,0|3,0,0]=4 2681 B9R1.41 Nc1c[nH]nc1C(=O)O 1P000BTK [0,0,0,0,1,0|3,0,0]=4 2682 B9R1.41 Nc1cn[nH]c1C(=O)O 1P009WJM [0,0,0,0,1,0|3,0,0]=4 2683 B9R1.41 Nc1csnc1C(=O)O 1P005R0T [0,0,0,0,1,0|3,0,0]=4 2684 B9R1.41 Nc1n[nH]cc1C(=O)O 1P003425 [0,0,0,0,1,0|3,0,0]=4 2685 B9R1.41 Nc1sccc1C(=O)O 1P00EAZ3 [0,0,0,0,1,0|2,0,0]=3 2686 B9R1.41 O=C(C1=C(Br)SN=C1)O 1P01KCRT [0,0,0,0,1,0|3,0,0]=4 2687 B9R1.41 OC(=O)c1[nH]ccc1Br 1P001DWJ [0,0,0,0,1,0|2,0,0]=3 2688 B9R1.41 OC(=O)c1[nH]ccc1C 1P006BCT [0,0,0,0,1,0|2,0,0]=3 2689 B9R1.41 OC(=O)c1c(Br)cn[nH]1 1P008VW1 [0,0,0,0,1,0|3,0,0]=4 2690 B9R1.41 OC(=O)c1c(Br)nc[nH]1 1P00JSC8 [0,0,0,0,1,0|3,0,0]=4 2691 B9R1.41 OC(=O)c1c(Cl)cn[nH]1 1P004RQV [0,0,0,0,1,0|3,0,0]=4 2692 B9R1.41 OC(=O)c1c(Cl)nc[nH]1 1P020MPN [0,0,0,0,1,0|3,0,0]=4 2693 B9R1.41 OC(=O)c1c(I)cn[nH]1 1P006LYK [0,0,0,0,1,0|3,0,0]=4 2694 B9R1.41 OC(=O)c1c[nH]nc1Cl 1P009I65 [0,0,0,0,1,0|3,0,0]=4 2695 B9R1.41 OC(=O)c1c[nH]nc1I 1P01KZM6 [0,0,0,0,1,0|3,0,0]=4 2696 B9R1.41 OC(=O)c1cccn1C 1P00ICFR [0,0,0,0,1,0|2,0,0]=3 2697 B9R1.41 OC(=O)c1ccoc1Br 1P002BKS [0,0,0,0,1,0|2,0,0]=3 2698 B9R1.41 OC(=O)c1ccoc1Cl 1P007JLL [0,0,0,0,1,0|2,0,0]=3 2699 B9R1.41 OC(=O)c1ccoc1I 1P00KE9C [0,0,0,0,1,0|2,0,0]=3 2700 B9R1.41 OC(=O)c1ccsc1Br 1P0033LT [0,0,0,0,1,0|2,0,0]=3 2701 B9R1.41 OC(=O)c1ccsc1Cl 1P00DE30 [0,0,0,0,1,0|2,0,0]=3 2702 B9R1.41 OC(=O)c1ccsc1F 1P006BTP [0,0,0,0,1,0|2,0,0]=3 2703 B9R1.41 OC(=O)c1ccsc1I 1P002I22 [0,0,0,0,1,0|2,0,0]=3 2704 B9R1.41 OC(=O)c1cn[nH]c1Br 1P01BWDO [0,0,0,0,1,0|3,0,0]=4 2705 B9R1.41 OC(=O)c1cn[nH]c1Cl 1P0081IG [0,0,0,0,1,0|3,0,0]=4 2706 B9R1.41 OC(=O)c1cocc1Br 1P020M53 [0,0,0,0,1,0|2,0,0]=3 2707 B9R1.41 OC(=O)c1cscc1Br 1P001XH6 [0,0,0,0,1,0|2,0,0]=3 2708 B9R1.41 OC(=O)c1cscc1Cl 1P019TZV [0,0,0,0,1,0|2,0,0]=3 2709 B9R1.41 OC(=O)c1cscc1F 1P008O78 [0,0,0,0,1,0|2,0,0]=3 2710 B9R1.41 OC(=O)c1cscc1I 1P0055VX [0,0,0,0,1,0|2,0,0]=3 2711 B9R1.41 OC(=O)c1csnc1Br 1P01BZ36 [0,0,0,0,1,0|3,0,0]=4 2712 B9R1.41 OC(=O)c1csnc1Cl 1P006GOM [0,0,0,0,1,0|3,0,0]=4 2713 B9R1.41 OC(=O)c1n[nH]cc1Br 1P0013R2 [0,0,0,0,1,0|3,0,0]=4 2714 B9R1.41 OC(=O)c1n[nH]cc1F 1P019U2K [0,0,0,0,1,0|3,0,0]=4 2715 B9R1.41 OC(=O)c1n[nH]cc1I 1P01K16F [0,0,0,0,1,0|3,0,0]=4 2716 B9R1.41 OC(=O)c1nccn1C 1P002A6Y [0,0,0,0,1,0|3,0,0]=4 2717 B9R1.41 OC(=O)c1ncoc1Br 1P000LYR [0,0,0,0,1,0|3,0,0]=4 2718 B9R1.41 OC(=O)c1ncsc1Br 1P003N1R [0,0,0,0,1,0|3,0,0]=4 2719 B9R1.41 OC(=O)c1nocc1Br 1P028H8R [0,0,0,0,1,0|3,0,0]=4 2720 B9R1.41 OC(=O)c1nocc1Cl 1P01EL98 [0,0,0,0,1,0|3,0,0]=4 2721 B9R1.41 OC(=O)c1nscc1Br 1P00I8ZX [0,0,0,0,1,0|3,0,0]=4 2722 B9R1.41 OC(=O)c1nscc1N 1P01A093 [0,0,0,0,1,0|3,0,0]=4 2723 B9R1.41 OC(=O)c1nscc1O 1P0026ER [0,0,0,0,1,0|2,0,0]=3 2724 B9R1.41 OC(=O)c1occc1Br 1P001LTO [0,0,0,0,1,0|2,0,0]=3 2725 B9R1.41 OC(=O)c1occc1C 1P003K7Z [0,0,0,0,1,0|2,0,0]=3 2726 B9R1.41 OC(=O)c1occc1Cl 1P01BB0X [0,0,0,0,1,0|2,0,0]=3 2727 B9R1.41 OC(=O)c1occc1F 1P027RMC [0,0,0,0,1,0|2,0,0]=3 2728 B9R1.41 OC(=O)c1ocnc1Br 1P021TPK [0,0,0,0,1,0|3,0,0]=4 2729 B9R1.41 OC(=O)c1sccc1Br 1P0036HF [0,0,0,0,1,0|2,0,0]=3 2730 B9R1.41 OC(=O)c1sccc1C 1P00347S [0,0,0,0,1,0|2,0,0]=3 2731 B9R1.41 OC(=O)c1sccc1Cl 1P00392Q [0,0,0,0,1,0|2,0,0]=3 2732 B9R1.41 OC(=O)c1sccc1F 1P00BYYA [0,0,0,0,1,0|2,0,0]=3 2733 B9R1.41 OC(=O)c1sccc1I 1P0037XF [0,0,0,0,1,0|2,0,0]=3 2734 B9R1.41 OC(=O)c1sccc1N 1P003JBB [0,0,0,0,1,0|2,0,0]=3 2735 B9R1.41 OC(=O)c1sccc1O 1P00D9E3 [0,0,0,0,1,0|1,0,0]=2 2736 B9R1.41 OC(=O)c1scnc1Br 1P000MK2 [0,0,0,0,1,0|3,0,0]=4 2737 B9R1.41 OC(=O)c1scnc1Cl 1P00DL89 [0,0,0,0,1,0|3,0,0]=4 2738 B9R1.41 OC(=O)c1scnc1I 1P027VG4 [0,0,0,0,1,0|3,0,0]=4 2739 B9R1.41 OC(=O)c1sncc1Br 1P01A4FX [0,0,0,0,1,0|3,0,0]=4 2740 B9R1.41 OS(=O)c1cscc1Br 1P028ODS [0,0,0,0,1,0|3,0,0]=4 2741 B9R1.41 [O-]C(=O)c1sccc1N 1P01T6ZE [0,0,0,0,1,0|2,0,1]=4 2742 B9R1.41 [O-][N+](=O)c1sccc1O 1P01APJJ [0,0,0,0,1,0|2,0,1]=4 2743 B11R1.86 BrC(=Cc1ccccc1F)Br 1P01BSTG [0,0,0,0,0,1|3,0,0]=4 2744 B11R1.86 CC(=O)Cc1ccccc1Br 1P003H9D [0,0,0,0,0,1|2,0,0]=3 2745 B11R1.86 CC(=O)Cc1ccccc1C 1P00D954 [0,0,0,0,0,1|2,0,0]=3 2746 B11R1.86 CC(=O)Cc1ccccc1Cl 1P003DAJ [0,0,0,0,0,1|2,0,0]=3 2747 B11R1.86 CC(=O)Cc1ccccc1F 1P003BOY [0,0,0,0,0,1|2,0,0]=3 2748 B11R1.86 CC(=O)Cc1ccccc1I 1P01ALIT [0,0,0,0,0,1|2,0,0]=3 2749 B11R1.86 CC(=O)Cc1ccccc1O 1P000VSR [0,0,0,0,0,1|1,0,0]=2 2750 B11R1.86 CC(=O)Cc1ccncc1C 1P028QLT [0,0,0,0,0,1|3,0,0]=4 2751 B11R1.86 CC(=O)Cc1ncccc1Br 1P01A0L8 [0,0,0,0,0,1|3,0,0]=4 2752 B11R1.86 CC(=O)Cc1ncccc1C 1P00C8O3 [0,0,0,0,0,1|3,0,0]=4 2753 B11R1.86 CC(=O)Cc1ncccc1Cl 1P01ALQN [0,0,0,0,0,1|3,0,0]=4 2754 B11R1.86 CC(=O)Cn1ccccc1=O 1P01BEJK [0,0,0,0,0,1|2,0,1]=4 2755 B11R1.86 CC(=O)Nc1ccccc1Br 1P003BNA [0,0,0,0,0,1|2,0,0]=3 2756 B11R1.86 CC(=O)Nc1ccccc1C 1P000QH9 [0,0,0,0,0,1|2,0,0]=3 2757 B11R1.86 CC(=O)Nc1ccccc1Cl 1P003BO5 [0,0,0,0,0,1|2,0,0]=3 2758 B11R1.86 CC(=O)Nc1ccccc1F 1P003BOW [0,0,0,0,0,1|2,0,0]=3 2759 B11R1.86 CC(=O)Nc1ccccc1I 1P007RN6 [0,0,0,0,0,1|2,0,0]=3 2760 B11R1.86 CC(=O)Nc1ccccc1N 1P003BMT [0,0,0,0,0,1|2,0,0]=3 2761 B11R1.86 CC(=O)Nc1ccccc1O 1P003GR9 [0,0,0,0,0,1|1,0,0]=2 2762 B11R1.86 CC(=O)Nc1cccnc1N 1P01A75N [0,0,0,0,0,1|3,0,0]=4 2763 B11R1.86 CC(=O)Nc1cccnc1O 1P00G9SH [0,0,0,0,0,1|2,0,0]=3 2764 B11R1.86 CC(=O)Nc1ccncc1C 1P008Z6R [0,0,0,0,0,1|3,0,0]=4 2765 B11R1.86 CC(=O)Nc1ccncc1I 1P01SP48 [0,0,0,0,0,1|3,0,0]=4 2766 B11R1.86 CC(=O)Nc1ccncc1N 1P001L6W [0,0,0,0,0,1|3,0,0]=4 2767 B11R1.86 CC(=O)Nc1ncccc1C 1P005WE9 [0,0,0,0,0,1|3,0,0]=4 2768 B11R1.86 CC(=O)Nc1ncccc1O 1P00CKHR [0,0,0,0,0,1|2,0,0]=3 2769 B11R1.86 CC(=O)Oc1ccccc1Br 1P0024OT [0,0,0,0,0,1|2,0,0]=3 2770 B11R1.86 CC(=O)Oc1ccccc1Cl 1P003HJS [0,0,0,0,0,1|2,0,0]=3 2771 B11R1.86 CC(=O)Oc1ccccc1I 1P00C7MR [0,0,0,0,0,1|2,0,0]=3 2772 B11R1.86 CC(=O)Oc1ccccc1O 1P01BUNR [0,0,0,0,0,1|1,0,0]=2 2773 B11R1.86 CC(=O)Oc1coccc1=O 1P028MQ2 [0,0,0,0,0,1|2,0,1]=4 2774 B11R1.86 CC(Cc1ccccc1Cl)O 1P01EXHL [0,0,0,0,0,1|2,0,1]=4 2775 B11R1.86 CC(Cc1ccccc1O)C 1P00D6I3 [0,0,0,0,0,1|2,0,1]=4 2776 B11R1.86 CC(Cc1ccccc1O)N 1P01DX8H [0,0,0,0,0,1|2,0,1]=4 2777 B11R1.86 CC(Oc1ccccc1O)C 1P003HY4 [0,0,0,0,0,1|2,0,1]=4 2778 B11R1.86 CS(=O)Cc1ccccc1N 1P01AC6V [0,0,0,0,0,1|3,0,0]=4 2779 B11R1.86 Cc1ccncc1CC(=O)O 1P01AVGM [0,0,0,0,0,1|2,0,0]=3 2780 B11R1.86 Cc1ccncc1CC(=O)O 1P01B59V [0,0,0,0,0,1|2,0,0]=3 2781 B11R1.86 Cc1ccncc1NC(=O)C 1P00DMO8 [0,0,0,0,0,1|3,0,0]=4 2782 B11R1.86 Cc1ncccc1CC(=O)O 1P01BAVJ [0,0,0,0,0,1|2,0,0]=3 2783 B11R1.86 ClC(=O)Cc1ccccc1Cl 1P003HJY [0,0,0,0,0,1|2,0,0]=3 2784 B11R1.86 ClC(=O)Cc1ccccc1F 1P003F8E [0,0,0,0,0,1|2,0,0]=3 2785 B11R1.86 ClC(=O)Oc1ccccc1C 1P007RD1 [0,0,0,0,0,1|2,0,0]=3 2786 B11R1.86 ClC(=O)Oc1ccccc1Cl 1P007RD2 [0,0,0,0,0,1|2,0,0]=3 2787 B11R1.86 ClC(=O)Oc1ccccc1F 1P01BCPK [0,0,0,0,0,1|2,0,0]=3 2788 B11R1.86 FC(Oc1ccccc1O)F 1P00DIEB [0,0,0,0,0,1|2,0,1]=4 2789 B11R1.86 FC(Sc1ccccc1O)F 1P01ALOG [0,0,0,0,0,1|2,0,1]=4 2790 B11R1.86 NC(=N)Cc1ccccc1Br 1P009BM9 [0,0,0,0,0,1|3,0,0]=4 2791 B11R1.86 NC(=N)Cc1ccccc1C 1P00JTDN [0,0,0,0,0,1|3,0,0]=4 2792 B11R1.86 NC(=N)Cc1ccccc1Cl 1P00DK5P [0,0,0,0,0,1|3,0,0]=4 2793 B11R1.86 NC(=N)Cc1ccccc1F 1P00IED3 [0,0,0,0,0,1|3,0,0]=4 2794 B11R1.86 NC(=N)Nc1ccccc1C 1P00C6NB [0,0,0,0,0,1|3,0,0]=4 2795 B11R1.86 NC(=N)Nc1ccccc1C 1P00FEG8 [0,0,0,0,0,1|3,0,0]=4 2796 B11R1.86 NC(=N)Nc1ccccc1Cl 1P00C3UH [0,0,0,0,0,1|3,0,0]=4 2797 B11R1.86 NC(=O)Cc1ccccc1C 1P00C7O3 [0,0,0,0,0,1|2,0,0]=3 2798 B11R1.86 NC(=O)Cc1ccccc1Cl 1P0008KE [0,0,0,0,0,1|2,0,0]=3 2799 B11R1.86 NC(=O)Cc1ccccc1F 1P00I6ND [0,0,0,0,0,1|2,0,0]=3 2800 B11R1.86 NC(=O)Cc1ccccc1N 1P00BZX4 [0,0,0,0,0,1|2,0,0]=3 2801 B11R1.86 NC(=O)Cc1ccccc1O 1P006Y9M [0,0,0,0,0,1|1,0,0]=2 2802 B11R1.86 NC(=O)Nc1ccccc1Br 1P000W2U [0,0,0,0,0,1|2,0,0]=3 2803 B11R1.86 NC(=O)Nc1ccccc1C 1P003TZ2 [0,0,0,0,0,1|2,0,0]=3 2804 B11R1.86 NC(=O)Nc1ccccc1Cl 1P000AQ3 [0,0,0,0,0,1|2,0,0]=3 2805 B11R1.86 NC(=O)Nc1ccccc1F 1P003HSV [0,0,0,0,0,1|2,0,0]=3 2806 B11R1.86 NC(=S)Cc1ccccc1Br 1P008SJN [0,0,0,0,0,1|2,1,0]=4 2807 B11R1.86 NC(=S)Cc1ccccc1F 1P00H9ZX [0,0,0,0,0,1|2,1,0]=4 2808 B11R1.86 NC(=S)Nc1ccccc1Br 1P003865 [0,0,0,0,0,1|2,1,0]=4 2809 B11R1.86 NC(=S)Nc1ccccc1C 1P00IBBO [0,0,0,0,0,1|2,1,0]=4 2810 B11R1.86 NC(=S)Nc1ccccc1Cl 1P0032OG [0,0,0,0,0,1|2,1,0]=4 2811 B11R1.86 NC(=S)Nc1ccccc1F 1P003BFU [0,0,0,0,0,1|2,1,0]=4 2812 B11R1.86 Nc1ncccc1CC(=O)O 1P000686 [0,0,0,0,0,1|2,0,0]=3 2813 B11R1.86 Nc1ncccc1CC(=O)O 1P01BE2W [0,0,0,0,0,1|2,0,0]=3 2814 B11R1.86 OB(Cc1ccccc1Cl)O 1P018SHU [0,0,0,0,0,1|2,0,1]=4 2815 B11R1.86 OC(=O)Cc1ccc[nH]c1=O 1P01KJHL [0,0,0,0,0,1|1,0,1]=3 2816 B11R1.86 OC(=O)Cc1ccccc1Br 1P0033NF [0,0,0,0,0,1|1,0,0]=2 2817 B11R1.86 OC(=O)Cc1ccccc1C 1P003I6V [0,0,0,0,0,1|1,0,0]=2 2818 B11R1.86 OC(=O)Cc1ccccc1Cl 1P003HJX [0,0,0,0,0,1|1,0,0]=2 2819 B11R1.86 OC(=O)Cc1ccccc1F 1P003HSU [0,0,0,0,0,1|1,0,0]=2 2820 B11R1.86 OC(=O)Cc1ccccc1I 1P0033TV [0,0,0,0,0,1|1,0,0]=2 2821 B11R1.86 OC(=O)Cc1ccccc1N 1P00BXSN [0,0,0,0,0,1|1,0,0]=2 2822 B11R1.86 OC(=O)Cc1ccccc1O 1P0033TN [0,0,0,0,0,1|0,0,0]=1 2823 B11R1.86 OC(=O)Cc1cccnc1Br 1P000JSL [0,0,0,0,0,1|2,0,0]=3 2824 B11R1.86 OC(=O)Cc1cccnc1Cl 1P00392A [0,0,0,0,0,1|2,0,0]=3 2825 B11R1.86 OC(=O)Cc1cccnc1F 1P00015G [0,0,0,0,0,1|2,0,0]=3 2826 B11R1.86 OC(=O)Cc1ccncc1C 1P01ADGP [0,0,0,0,0,1|2,0,0]=3 2827 B11R1.86 OC(=O)Cc1ccncc1N 1P008D16 [0,0,0,0,0,1|2,0,0]=3 2828 B11R1.86 OC(=O)Cc1cnc[nH]c1=O 1P0285W9 [0,0,0,0,0,1|2,0,1]=4 2829 B11R1.86 OC(=O)Cc1cnccc1Cl 1P01BAKZ [0,0,0,0,0,1|2,0,0]=3 2830 B11R1.86 OC(=O)Cc1ncccc1Br 1P00668C [0,0,0,0,0,1|2,0,0]=3 2831 B11R1.86 OC(=O)Cc1ncccc1C 1P00J3E2 [0,0,0,0,0,1|2,0,0]=3 2832 B11R1.86 OC(=O)Cc1ncccc1Cl 1P003JSB [0,0,0,0,0,1|2,0,0]=3 2833 B11R1.86 OC(=O)Cc1ncccc1F 1P00015F [0,0,0,0,0,1|2,0,0]=3 2834 B11R1.86 OC(=O)Cc1ncccc1F 1P01BGTL [0,0,0,0,0,1|2,0,0]=3 2835 B11R1.86 OC(=O)Cc1nccnc1Cl 1P00A11T [0,0,0,0,0,1|3,0,0]=4 2836 B11R1.86 OC(=O)Cc1nccnc1Cl 1P00I1YQ [0,0,0,0,0,1|3,0,0]=4 2837 B11R1.86 OC(=O)Cn1ccccc1=N 1P000STV [0,0,0,0,0,1|2,0,0]=3 2838 B11R1.86 OC(=O)Cn1ccccc1=O 1P00EE85 [0,0,0,0,0,1|1,0,1]=3 2839 B11R1.86 OC(=O)Cn1cccnc1=O 1P006P20 [0,0,0,0,0,1|2,0,1]=4 2840 B11R1.86 OC(=O)Cn1cnccc1=O 1P01C2ES [0,0,0,0,0,1|2,0,1]=4 2841 B11R1.86 OC(=O)Cn1ncccc1=O 1P00JATE [0,0,0,0,0,1|2,0,1]=4 2842 B11R1.86 [O-]C(=O)Cc1ccccc1N 1P00EO9O [0,0,0,0,0,1|1,0,1]=3 2843 B11R1.86 [O-]C(=O)Cc1ccncc1Cl 1P01FLEZ [0,0,0,0,0,1|2,0,1]=4 2844 B11R1.86 [O-]C(=O)Cc1ccncc1F 1P028HR9 [0,0,0,0,0,1|2,0,1]=4 2845 B11R1.86 [O-]C(=O)Cc1ncccc1Cl 1P001V8Q [0,0,0,0,0,1|2,0,1]=4 2846 B11R1.86 [O-][N+](=O)Cc1ccccc1F 1P0290A8 [0,0,0,0,0,1|2,0,1]=4 2847 B8R0.7 CC\C=C\C=C\C(=O)O 1P028PCP [1,0,1,0,0,0|0,0,2]=4 2848 B8R0.7 NC\C=C\C=C\C(=O)O 1P0282JT [1,0,1,0,0,0|1,0,1]=4 2849 B8R1.2 BrCc1ccccc1 1P0000N4 [2,0,0,0,0,0|1,0,1]=4 2850 B8R1.2 Br[Mg]c1ccccc1 1P0000NW [2,0,0,0,0,0|2,0,0]=4 2851 B8R1.2 Br[Se]c1ccccc1 1P00399Q [2,0,0,0,0,0|2,0,0]=4 2852 B8R1.2 C#Cc1ccccc1 1P0037R1 [2,0,0,0,0,0|1,0,1]=4 2853 B8R1.2 C=C[n+]1ccccc1 1P01EWMV [2,0,0,0,0,0|2,0,0]=4 2854 B8R1.2 C=Cc1ccccc1 1P0000N1 [2,0,0,0,0,0|1,0,0]=3 2855 B8R1.2 C=Cc1ccccc1 1P00C4A8 [2,0,0,0,0,0|1,0,0]=3 2856 B8R1.2 C=Cc1cccnc1 1P003491 [2,0,0,0,0,0|2,0,0]=4 2857 B8R1.2 C=Cc1ccncc1 1P0000N0 [2,0,0,0,0,0|2,0,0]=4 2858 B8R1.2 CCc1ccccc1 1P0000N2 [2,0,0,0,0,0|1,0,1]=4 2859 B8R1.2 CNc1ccccc1 1P0000NT [2,0,0,0,0,0|2,0,0]=4 2860 B8R1.2 CNc1ccccc1 1P003TNS [2,0,0,0,0,0|2,0,0]=4 2861 B8R1.2 COc1ccccc1 1P0000NO [2,0,0,0,0,0|2,0,0]=4 2862 B8R1.2 CSc1ccccc1 1P0000NM [2,0,0,0,0,0|2,0,0]=4 2863 B8R1.2 C[SiH2]c1ccccc1 1P005JR8 [2,0,0,0,0,0|1,1,0]=4 2864 B8R1.2 Cl[Mg]c1ccccc1 1P0000NV [2,0,0,0,0,0|2,0,0]=4 2865 B8R1.2 Cl[Se]c1ccccc1 1P0035XY [2,0,0,0,0,0|2,0,0]=4 2866 B8R1.2 ICc1ccccc1 1P0037QF [2,0,0,0,0,0|1,0,1]=4 2867 B8R1.2 N#Cc1ccccc1 1P0000MW [2,0,0,0,0,0|1,0,1]=4 2868 B8R1.2 N#Cc1ccccc1 1P001LN2 [2,0,0,0,0,0|1,0,1]=4 2869 B8R1.2 N#Cc1ccccc1 1P003OQS [2,0,0,0,0,0|1,0,1]=4 2870 B8R1.2 N#[N+]c1ccccc1 1P00CLKS [2,0,0,0,0,0|2,0,0]=4 2871 B8R1.2 NCc1ccccc1 1P0000MX [2,0,0,0,0,0|1,0,1]=4 2872 B8R1.2 NCc1ccccc1 1P003OLG [2,0,0,0,0,0|1,0,1]=4 2873 B8R1.2 NCc1ccccc1 1P00BYUK [2,0,0,0,0,0|1,0,1]=4 2874 B8R1.2 NCc1ccccc1 1P00DH5Y [2,0,0,0,0,0|1,0,1]=4 2875 B8R1.2 NNc1ccccc1 1P0000NR [2,0,0,0,0,0|2,0,0]=4 2876 B8R1.2 NNc1ccccc1 1P0035XW [2,0,0,0,0,0|2,0,0]=4 2877 B8R1.2 NNc1ccccc1 1P003U6F [2,0,0,0,0,0|2,0,0]=4 2878 B8R1.2 NOc1ccccc1 1P0037K5 [2,0,0,0,0,0|2,0,0]=4 2879 B8R1.2 O=Cc1ccccn1 1P0033WE [2,0,0,0,0,0|1,0,0]=3 2880 B8R1.2 O=Cc1cccnc1 1P00348S [2,0,0,0,0,0|1,0,0]=3 2881 B8R1.2 O=Cc1cccnn1 1P00EGBR [2,0,0,0,0,0|2,0,0]=4 2882 B8R1.2 O=Cc1ccncc1 1P0034LU [2,0,0,0,0,0|1,0,0]=3 2883 B8R1.2 O=Cc1ccncc1 1P003MH5 [2,0,0,0,0,0|1,0,0]=3 2884 B8R1.2 O=Cc1ccncn1 1P00360K [2,0,0,0,0,0|2,0,0]=4 2885 B8R1.2 O=Cc1ccnnc1 1P0037UD [2,0,0,0,0,0|2,0,0]=4 2886 B8R1.2 O=Cc1cnccn1 1P003937 [2,0,0,0,0,0|2,0,0]=4 2887 B8R1.2 O=Cc1cncnc1 1P00034V [2,0,0,0,0,0|2,0,0]=4 2888 B8R1.2 O=Cc1ncccn1 1P003A3I [2,0,0,0,0,0|2,0,0]=4 2889 B8R1.2 O=Nc1ccccc1 1P003AHD [2,0,0,0,0,0|1,0,0]=3 2890 B8R1.2 O=Nc1ccccn1 1P004ZQ7 [2,0,0,0,0,0|2,0,0]=4 2891 B8R1.2 O=[As]c1ccccc1 1P003U68 [2,0,0,0,0,0|1,0,0]=3 2892 B8R1.2 O=[I]c1ccccc1 1P0037R0 [2,0,0,0,0,0|1,0,0]=3 2893 B8R1.2 OCc1ccccc1 1P0000MS [2,0,0,0,0,0|0,0,1]=3 2894 B8R1.2 OCc1ccccn1 1P003UIQ [2,0,0,0,0,0|1,0,1]=4 2895 B8R1.2 OCc1cccnc1 1P0000NZ [2,0,0,0,0,0|1,0,1]=4 2896 B8R1.2 OCc1ccncc1 1P0034J2 [2,0,0,0,0,0|1,0,1]=4 2897 B8R1.2 OCc1ccncc1 1P00IBZH [2,0,0,0,0,0|1,0,1]=4 2898 B8R1.2 ONc1ccccc1 1P0000NP [2,0,0,0,0,0|1,0,0]=3 2899 B8R1.2 ONc1ccccc1 1P00G4MK [2,0,0,0,0,0|1,0,0]=3 2900 B8R1.2 SCc1ccccc1 1P0000O1 [2,0,0,0,0,0|0,1,1]=4 2901 B8R1.2 [C-]#[N+]c1ccccc1 1P006IKG [2,0,0,0,0,0|2,0,0]=4 2902 B8R1.2 [Mg+]Cc1ccccc1 1P005L1K [2,0,0,0,0,0|1,0,1]=4 2903 B8R1.5 Brc1ccccc1Br 1P0039HG [2,0,0,0,0,0|2,0,0]=4 2904 B8R1.5 Brc1ccccc1I 1P003364 [2,0,0,0,0,0|2,0,0]=4 2905 B8R1.5 Brc1cccnc1O 1P00342L [2,0,0,0,0,0|2,0,0]=4 2906 B8R1.5 Cc1ccccc1Br 1P0033NP [2,0,0,0,0,0|1,0,1]=4 2907 B8R1.5 Cc1ccccc1Cl 1P0060OI [2,0,0,0,0,0|1,0,1]=4 2908 B8R1.5 Cc1ccccc1F 1P0060O5 [2,0,0,0,0,0|1,0,1]=4 2909 B8R1.5 Cc1ccccc1I 1P003HXP [2,0,0,0,0,0|1,0,1]=4 2910 B8R1.5 Cc1ccccc1N 1P003TYU [2,0,0,0,0,0|1,0,1]=4 2911 B8R1.5 Cc1ccccc1O 1P005GSC [2,0,0,0,0,0|0,0,1]=3 2912 B8R1.5 Cc1ccccc1S 1P001358 [2,0,0,0,0,0|0,1,1]=4 2913 B8R1.5 Cc1cccnc1O 1P006L3K [2,0,0,0,0,0|1,0,1]=4 2914 B8R1.5 Cc1ccncc1O 1P003K0L [2,0,0,0,0,0|1,0,1]=4 2915 B8R1.5 Cc1cnccc1O 1P00347V [2,0,0,0,0,0|1,0,1]=4 2916 B8R1.5 Clc1ccccc1Cl 1P00331E [2,0,0,0,0,0|2,0,0]=4 2917 B8R1.5 Clc1ccccc1I 1P00337B [2,0,0,0,0,0|2,0,0]=4 2918 B8R1.5 Clc1cccnc1O 1P003JS9 [2,0,0,0,0,0|2,0,0]=4 2919 B8R1.5 Fc1ccccc1Br 1P0033N6 [2,0,0,0,0,0|2,0,0]=4 2920 B8R1.5 Fc1ccccc1Cl 1P003A36 [2,0,0,0,0,0|2,0,0]=4 2921 B8R1.5 Fc1ccccc1I 1P003ESK [2,0,0,0,0,0|2,0,0]=4 2922 B8R1.5 Fc1ccccc1S 1P0033SM [2,0,0,0,0,0|1,1,0]=4 2923 B8R1.5 Fc1cccnc1O 1P003JVS [2,0,0,0,0,0|2,0,0]=4 2924 B8R1.5 Ic1ccccc1I 1P00E950 [2,0,0,0,0,0|2,0,0]=4 2925 B8R1.5 Ic1cccnc1O 1P008ZKZ [2,0,0,0,0,0|2,0,0]=4 2926 B8R1.5 Nc1ccccc1Br 1P0033MQ [2,0,0,0,0,0|2,0,0]=4 2927 B8R1.5 Nc1ccccc1Br 1P003H80 [2,0,0,0,0,0|2,0,0]=4 2928 B8R1.5 Nc1ccccc1Cl 1P0033PQ [2,0,0,0,0,0|2,0,0]=4 2929 B8R1.5 Nc1ccccc1Cl 1P003HI4 [2,0,0,0,0,0|2,0,0]=4 2930 B8R1.5 Nc1ccccc1F 1P0033SA [2,0,0,0,0,0|2,0,0]=4 2931 B8R1.5 Nc1ccccc1F 1P00DC77 [2,0,0,0,0,0|2,0,0]=4 2932 B8R1.5 Nc1ccccc1I 1P003HXD [2,0,0,0,0,0|2,0,0]=4 2933 B8R1.5 Nc1ccccc1N 1P0035WA [2,0,0,0,0,0|2,0,0]=4 2934 B8R1.5 Nc1ccccc1N 1P003TY8 [2,0,0,0,0,0|2,0,0]=4 2935 B8R1.5 Nc1ccccc1O 1P00FAMG [2,0,0,0,0,0|1,0,0]=3 2936 B8R1.5 Nc1ccccc1O 1P00I9LJ [2,0,0,0,0,0|1,0,0]=3 2937 B8R1.5 Nc1cccnc1O 1P00IB08 [2,0,0,0,0,0|2,0,0]=4 2938 B8R1.5 Nc1cccnc1O 1P01A8IE [2,0,0,0,0,0|2,0,0]=4 2939 B8R1.5 Nc1ccncc1O 1P003AUC [2,0,0,0,0,0|2,0,0]=4 2940 B8R1.5 Nc1ccncc1O 1P003L68 [2,0,0,0,0,0|2,0,0]=4 2941 B8R1.5 Nc1ccncc1O 1P008WTQ [2,0,0,0,0,0|2,0,0]=4 2942 B8R1.5 Nc1cnccc1O 1P00954L [2,0,0,0,0,0|2,0,0]=4 2943 B8R1.5 O=c1[nH]cccc1C 1P0001Z2 [2,0,0,0,0,0|2,0,0]=4 2944 B8R1.5 O=c1[nH]cccc1I 1P01FPD4 [2,0,0,0,0,0|2,0,0]=4 2945 B8R1.5 O=c1[nH]cccc1N 1P003AA1 [2,0,0,0,0,0|2,0,0]=4 2946 B8R1.5 O=c1cc[nH]cc1N 1P00IBMU [2,0,0,0,0,0|2,0,0]=4 2947 B8R1.5 O=c1ccccn1C 1P0032P3 [2,0,0,0,0,0|2,0,0]=4 2948 B8R1.5 O=c1ccccn1O 1P00G61C [2,0,0,0,0,0|1,0,0]=3 2949 B8R1.5 O=c1ccocc1O 1P003K0A [2,0,0,0,0,0|1,0,0]=3 2950 B8R1.5 O=c1occcc1Br 1P002CSI [2,0,0,0,0,0|2,0,0]=4 2951 B8R1.5 O=c1occcc1O 1P0038A5 [2,0,0,0,0,0|1,0,0]=3 2952 B8R1.5 Oc1c[nH]cnc1=O 1P01K5EN [2,0,0,0,0,0|2,0,0]=4 2953 B8R1.5 Oc1cccc[n+]1[O-] 1P000ZZ3 [2,0,0,0,0,0|1,0,1]=4 2954 B8R1.5 Oc1ccccc1Br 1P003A35 [2,0,0,0,0,0|1,0,0]=3 2955 B8R1.5 Oc1ccccc1Cl 1P003HJP [2,0,0,0,0,0|1,0,0]=3 2956 B8R1.5 Oc1ccccc1F 1P003HSS [2,0,0,0,0,0|1,0,0]=3 2957 B8R1.5 Oc1ccccc1O 1P000QI9 [2,0,0,0,0,0|0,0,0]=2 2958 B8R1.5 Oc1ccccc1O 1P01HPCV [2,0,0,0,0,0|0,0,0]=2 2959 B8R1.5 Oc1ccccc1S 1P003HZ2 [2,0,0,0,0,0|0,1,0]=3 2960 B8R1.5 Oc1cccnc1Br 1P0033LQ [2,0,0,0,0,0|2,0,0]=4 2961 B8R1.5 Oc1cccnc1C 1P00346K [2,0,0,0,0,0|1,0,1]=4 2962 B8R1.5 Oc1cccnc1Cl 1P0033O5 [2,0,0,0,0,0|2,0,0]=4 2963 B8R1.5 Oc1cccnc1F 1P0020B6 [2,0,0,0,0,0|2,0,0]=4 2964 B8R1.5 Oc1cccnc1I 1P003HX4 [2,0,0,0,0,0|2,0,0]=4 2965 B8R1.5 Oc1cccnc1N 1P003GUC [2,0,0,0,0,0|2,0,0]=4 2966 B8R1.5 Oc1ccncc1Br 1P003JIN [2,0,0,0,0,0|2,0,0]=4 2967 B8R1.5 Oc1ccncc1Cl 1P003JOW [2,0,0,0,0,0|2,0,0]=4 2968 B8R1.5 Oc1ccncc1F 1P0036K6 [2,0,0,0,0,0|2,0,0]=4 2969 B8R1.5 Oc1ccncc1I 1P003K2J [2,0,0,0,0,0|2,0,0]=4 2970 B8R1.5 Oc1cnc[nH]c1=O 1P001QMI [2,0,0,0,0,0|2,0,0]=4 2971 B8R1.5 Oc1cnccc1Br 1P001SX1 [2,0,0,0,0,0|2,0,0]=4 2972 B8R1.5 Oc1cnccc1Cl 1P0034G7 [2,0,0,0,0,0|2,0,0]=4 2973 B8R1.5 Oc1cnccc1I 1P002H4K [2,0,0,0,0,0|2,0,0]=4 2974 B8R1.5 Oc1cnccc1O 1P00063S [2,0,0,0,0,0|1,0,0]=3 2975 B8R1.5 Oc1ncccc1O 1P0036P2 [2,0,0,0,0,0|1,0,0]=3 2976 B8R1.5 Oc1nccnc1O 1P01EC4P [2,0,0,0,0,0|2,0,0]=4 2977 B8R1.5 S=c1[nH]cccc1O 1P002MAZ [2,0,0,0,0,0|1,1,0]=4 2978 B8R1.5 S=c1ccccn1O 1P008SNF [2,0,0,0,0,0|1,1,0]=4 2979 B8R1.5 S=c1ccccn1O 1P00HTTH [2,0,0,0,0,0|1,1,0]=4 2980 B8R1.5 Sc1ccccc1Br 1P003H9T [2,0,0,0,0,0|1,1,0]=4 2981 B8R1.5 Sc1ccccc1Cl 1P0033QH [2,0,0,0,0,0|1,1,0]=4 2982 B8R1.5 Sc1ccccc1I 1P00CMOS [2,0,0,0,0,0|1,1,0]=4 2983 B8R1.5 Sc1ccccc1S 1P0021E0 [2,0,0,0,0,0|0,2,0]=4 2984 B8R1.5 [O-]c1ccccc1C 1P00E08C [2,0,0,0,0,0|0,0,2]=4 2985 B10R1.13 Brc1ccc(cc1)N(=O)=O 1P0034L5 [1,1,0,0,0,0|1,0,1]=4 2986 B10R1.13 Brc1ccc(cc1)S(=O)C 1P006325 [1,1,0,0,0,0|2,0,0]=4 2987 B10R1.13 Brc1ccc(cc1)S(=O)O 1P000JDB [1,1,0,0,0,0|1,0,0]=3 2988 B10R1.13 Brc1ccc(cc1)S(=O)[O-] 1P0021BJ [1,1,0,0,0,0|1,0,1]=4 2989 B10R1.13 Brc1ccc(cc1)S(=O)[O-] 1P01BEXB [1,1,0,0,0,0|1,0,1]=4 2990 B10R1.13 Brc1ccc(cn1)C(=O)C 1P001AJL [1,1,0,0,0,0|2,0,0]=4 2991 B10R1.13 Brc1ccc(cn1)C(=O)N 1P0089SG [1,1,0,0,0,0|2,0,0]=4 2992 B10R1.13 Brc1ccc(cn1)C(=O)O 1P003NLL [1,1,0,0,0,0|1,0,0]=3 2993 B10R1.13 Brc1ccc(nc1)C(=O)C 1P0033JA [1,1,0,0,0,0|2,0,0]=4 2994 B10R1.13 Brc1ccc(nc1)C(=O)C 1P01BH9H [1,1,0,0,0,0|2,0,0]=4 2995 B10R1.13 Brc1ccc(nc1)C(=O)Cl 1P0013CR [1,1,0,0,0,0|2,0,0]=4 2996 B10R1.13 Brc1ccc(nc1)C(=O)N 1P00GTTW [1,1,0,0,0,0|2,0,0]=4 2997 B10R1.13 Brc1ccc(nc1)C(=O)O 1P0031O7 [1,1,0,0,0,0|1,0,0]=3 2998 B10R1.13 CC(=C)c1ccc(cc1)Br 1P01DFHT [1,1,0,0,0,0|2,0,0]=4 2999 B10R1.13 CC(=C)c1ccc(cc1)Cl 1P003LMX [1,1,0,0,0,0|2,0,0]=4 3000 B10R1.13 CC(=C)c1ccc(cc1)F 1P003ESP [1,1,0,0,0,0|2,0,0]=4 3001 B10R1.13 CC(=C)c1ccc(cc1)I 1P01DFI7 [1,1,0,0,0,0|2,0,0]=4 3002 B10R1.13 CC(=C)c1ccc(cc1)O 1P003U4X [1,1,0,0,0,0|2,0,0]=4 3003 B10R1.13 CC(=O)c1cc[n+](cc1)[O-] 1P00BCEM [1,1,0,0,0,0|2,0,0]=4 3004 B10R1.13 CC(=O)c1ccc(cc1)Br 1P0034EQ [1,1,0,0,0,0|1,0,0]=3 3005 B10R1.13 CC(=O)c1ccc(cc1)Cl 1P0034GF [1,1,0,0,0,0|1,0,0]=3 3006 B10R1.13 CC(=O)c1ccc(cc1)F 1P0034HV [1,1,0,0,0,0|1,0,0]=3 3007 B10R1.13 CC(=O)c1ccc(cc1)I 1P00150G [1,1,0,0,0,0|1,0,0]=3 3008 B10R1.13 CC(=O)c1ccc(cc1)N 1P003L7C [1,1,0,0,0,0|1,0,0]=3 3009 B10R1.13 CC(=O)c1ccc(cc1)N 1P003L7D [1,1,0,0,0,0|1,0,0]=3 3010 B10R1.13 CC(=O)c1ccc(cc1)O 1P0034IP [1,1,0,0,0,0|1,0,0]=3 3011 B10R1.13 CC(=O)c1ccc(cc1)S 1P00CAPQ [1,1,0,0,0,0|1,0,0]=3 3012 B10R1.13 CC(c1ccc(cc1)Br)O 1P003DF9 [1,1,0,0,0,0|1,0,1]=4 3013 B10R1.13 CC(c1ccc(cc1)Cl)O 1P003DFQ [1,1,0,0,0,0|1,0,1]=4 3014 B10R1.13 CC(c1ccc(cc1)F)O 1P003DGC [1,1,0,0,0,0|1,0,1]=4 3015 B10R1.13 CC(c1ccc(cc1)I)O 1P00DZFM [1,1,0,0,0,0|1,0,1]=4 3016 B10R1.13 CC(c1ccc(cc1)N)O 1P001DTE [1,1,0,0,0,0|1,0,1]=4 3017 B10R1.13 CC(c1ccc(cc1)S)O 1P01BD1Q [1,1,0,0,0,0|1,0,1]=4 3018 B10R1.13 CC1=CCC(=CC1)C(=O)O 1P01DU9K [1,1,0,0,0,0|0,0,2]=4 3019 B10R1.13 C[C@@H](c1ccc(cc1)Br)O 1P0003B7 [1,1,0,0,0,0|1,0,1]=4 3020 B10R1.13 C[C@@H](c1ccc(cc1)Cl)O 1P003D38 [1,1,0,0,0,0|1,0,1]=4 3021 B10R1.13 C[C@@H](c1ccc(cc1)F)O 1P0004GE [1,1,0,0,0,0|1,0,1]=4 3022 B10R1.13 C[C@@H](c1ccc(cc1)I)O 1P01AH65 [1,1,0,0,0,0|1,0,1]=4 3023 B10R1.13 C[C@@H](c1ccc(cc1)N)O 1P01A474 [1,1,0,0,0,0|1,0,1]=4 3024 B10R1.13 C[C@H](c1ccc(cc1)Br)O 1P003CQX [1,1,0,0,0,0|1,0,1]=4 3025 B10R1.13 C[C@H](c1ccc(cc1)Cl)O 1P003CQY [1,1,0,0,0,0|1,0,1]=4 3026 B10R1.13 C[C@H](c1ccc(cc1)F)O 1P0004GH [1,1,0,0,0,0|1,0,1]=4 3027 B10R1.13 C[C@H](c1ccc(cc1)I)O 1P01AAE3 [1,1,0,0,0,0|1,0,1]=4 3028 B10R1.13 C[C@H](c1ccc(cc1)N)O 1P01A4RA [1,1,0,0,0,0|1,0,1]=4 3029 B10R1.13 Cc1ccc(cc1)C(=O)C 1P0034KH [1,1,0,0,0,0|1,0,0]=3 3030 B10R1.13 Cc1ccc(cc1)C(O)C 1P003DHB [1,1,0,0,0,0|1,0,1]=4 3031 B10R1.13 Cc1ccc(cc1)S(=O)C 1P003EYO [1,1,0,0,0,0|2,0,0]=4 3032 B10R1.13 Cc1ccc(cc1)S(=O)Cl 1P008Z3I [1,1,0,0,0,0|2,0,0]=4 3033 B10R1.13 Cc1ccc(cc1)S(=O)N 1P0034KI [1,1,0,0,0,0|2,0,0]=4 3034 B10R1.13 Cc1ccc(cc1)S(=O)O 1P001REW [1,1,0,0,0,0|1,0,0]=3 3035 B10R1.13 Cc1ccc(cc1)S(=O)O 1P00IA0Y [1,1,0,0,0,0|1,0,0]=3 3036 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P001YJL [1,1,0,0,0,0|1,0,1]=4 3037 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P002JRA [1,1,0,0,0,0|1,0,1]=4 3038 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P00362L [1,1,0,0,0,0|1,0,1]=4 3039 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P003UUH [1,1,0,0,0,0|1,0,1]=4 3040 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P00FCR3 [1,1,0,0,0,0|1,0,1]=4 3041 B10R1.13 Cc1ccc(cc1)[C@@H](O)C 1P00DA1A [1,1,0,0,0,0|1,0,1]=4 3042 B10R1.13 Cc1ccc(cc1)[C@H](O)C 1P00C0M3 [1,1,0,0,0,0|1,0,1]=4 3043 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] 1P0036PU [1,1,0,0,0,0|1,0,1]=4 3044 B10R1.13 Cc1ccc(cc1)[S@@](=O)C 1P003CVR [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.13 Cc1ccc(cc1)[S@@](=O)N 1P002PL9 [1,1,0,0,0,0|2,0,0]=4 3046 B10R1.13 Cc1ccc(cc1)[S@](=O)C 1P003CMM [1,1,0,0,0,0|2,0,0]=4 3047 B10R1.13 Cc1ccc(cc1)[S@](=O)N 1P002HDM [1,1,0,0,0,0|2,0,0]=4 3048 B10R1.13 Cc1ccc(cn1)C(=O)C 1P007AKR [1,1,0,0,0,0|2,0,0]=4 3049 B10R1.13 Cc1ccc(cn1)C(=O)N 1P005KIX [1,1,0,0,0,0|2,0,0]=4 3050 B10R1.13 Cc1ccc(cn1)C(=O)O 1P007HIP [1,1,0,0,0,0|1,0,0]=3 3051 B10R1.13 Cc1ccc(nc1)C(=O)C 1P003GRQ [1,1,0,0,0,0|2,0,0]=4 3052 B10R1.13 Cc1ccc(nc1)C(=O)C 1P00J2IE [1,1,0,0,0,0|2,0,0]=4 3053 B10R1.13 Cc1ccc(nc1)C(=O)N 1P00C4PA [1,1,0,0,0,0|2,0,0]=4 3054 B10R1.13 Cc1ccc(nc1)C(=O)O 1P0025QJ [1,1,0,0,0,0|1,0,0]=3 3055 B10R1.13 Cc1ccc(nc1)C(=O)O 1P0038BJ [1,1,0,0,0,0|1,0,0]=3 3056 B10R1.13 Cc1ccc(nn1)C(=O)O 1P003NRM [1,1,0,0,0,0|2,0,0]=4 3057 B10R1.13 Cc1cnc(cn1)C(=O)O 1P00IAB5 [1,1,0,0,0,0|2,0,0]=4 3058 B10R1.13 ClC(=C)c1ccc(cc1)Br 1P01DWVX [1,1,0,0,0,0|2,0,0]=4 3059 B10R1.13 ClC(=O)c1ccc(cc1)Br 1P00IAVO [1,1,0,0,0,0|1,0,0]=3 3060 B10R1.13 ClC(=O)c1ccc(cc1)C 1P003606 [1,1,0,0,0,0|1,0,0]=3 3061 B10R1.13 ClC(=O)c1ccc(cc1)F 1P003LVT [1,1,0,0,0,0|1,0,0]=3 3062 B10R1.13 ClC(=O)c1ccc(cc1)I 1P007UPD [1,1,0,0,0,0|1,0,0]=3 3063 B10R1.13 Clc1ccc(cc1)C(=O)Cl 1P003LNG [1,1,0,0,0,0|1,0,0]=3 3064 B10R1.13 Clc1ccc(cc1)S(=O)C 1P00GS94 [1,1,0,0,0,0|2,0,0]=4 3065 B10R1.13 Clc1ccc(cc1)S(=O)[O-] 1P001FFH [1,1,0,0,0,0|1,0,1]=4 3066 B10R1.13 Clc1ccc(cc1)[N+](=O)[O-] 1P0000MR [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.13 Clc1ccc(cn1)C(=O)C 1P0033OV [1,1,0,0,0,0|2,0,0]=4 3068 B10R1.13 Clc1ccc(cn1)C(=O)Cl 1P00IAWT [1,1,0,0,0,0|2,0,0]=4 3069 B10R1.13 Clc1ccc(cn1)C(=O)N 1P003NNG [1,1,0,0,0,0|2,0,0]=4 3070 B10R1.13 Clc1ccc(cn1)C(=O)O 1P003NNH [1,1,0,0,0,0|1,0,0]=3 3071 B10R1.13 Clc1ccc(nc1)C(=O)C 1P006R8V [1,1,0,0,0,0|2,0,0]=4 3072 B10R1.13 Clc1ccc(nc1)C(=O)Cl 1P000Y7Z [1,1,0,0,0,0|2,0,0]=4 3073 B10R1.13 Clc1ccc(nc1)C(=O)N 1P00CB78 [1,1,0,0,0,0|2,0,0]=4 3074 B10R1.13 Clc1ccc(nc1)C(=O)O 1P003N5J [1,1,0,0,0,0|1,0,0]=3 3075 B10R1.13 FC(=C)c1ccc(cc1)Br 1P01DWIQ [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.13 FC(=O)c1ccc(cc1)Br 1P005U0R [1,1,0,0,0,0|1,0,0]=3 3077 B10R1.13 FC(=O)c1ccc(cc1)I 1P0222K3 [1,1,0,0,0,0|1,0,0]=3 3078 B10R1.13 Fc1ccc(cc1)C(=O)F 1P024VDD [1,1,0,0,0,0|1,0,0]=3 3079 B10R1.13 Fc1ccc(cc1)N(=O)=O 1P0034I4 [1,1,0,0,0,0|1,0,1]=4 3080 B10R1.13 Fc1ccc(cc1)S(=O)C 1P00FD2V [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.13 Fc1ccc(cc1)S(=O)[O-] 1P00G2X2 [1,1,0,0,0,0|1,0,1]=4 3082 B10R1.13 Fc1ccc(cc1)[N+](=O)[O-] 1P0026NP [1,1,0,0,0,0|1,0,1]=4 3083 B10R1.13 Fc1ccc(cn1)C(=O)C 1P004Y7M [1,1,0,0,0,0|2,0,0]=4 3084 B10R1.13 Fc1ccc(cn1)C(=O)Cl 1P00EAWJ [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.13 Fc1ccc(cn1)C(=O)F 1P01OHCH [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.13 Fc1ccc(cn1)C(=O)N 1P00CZQN [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.13 Fc1ccc(cn1)C(=O)O 1P003NOK [1,1,0,0,0,0|1,0,0]=3 3088 B10R1.13 Fc1ccc(nc1)C(=O)C 1P00GSNJ [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.13 Fc1ccc(nc1)C(=O)C 1P028O6Q [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.13 Fc1ccc(nc1)C(=O)Cl 1P00FI5J [1,1,0,0,0,0|2,0,0]=4 3091 B10R1.13 Fc1ccc(nc1)C(=O)Cl 1P01C0I6 [1,1,0,0,0,0|2,0,0]=4 3092 B10R1.13 Fc1ccc(nc1)C(=O)N 1P00DIFZ [1,1,0,0,0,0|2,0,0]=4 3093 B10R1.13 Fc1ccc(nc1)C(=O)O 1P0034QI [1,1,0,0,0,0|1,0,0]=3 3094 B10R1.13 Fc1ccc(nc1)C(=O)O 1P01A6GL [1,1,0,0,0,0|1,0,0]=3 3095 B10R1.13 Ic1ccc(cc1)[N+](=O)[O-] 1P00391K [1,1,0,0,0,0|1,0,1]=4 3096 B10R1.13 Ic1ccc(cn1)C(=O)O 1P000V2T [1,1,0,0,0,0|1,0,0]=3 3097 B10R1.13 Ic1ccc(nc1)C(=O)O 1P00C9PY [1,1,0,0,0,0|1,0,0]=3 3098 B10R1.13 NC(=N)c1ccc(cc1)Br 1P0034ES [1,1,0,0,0,0|2,0,0]=4 3099 B10R1.13 NC(=N)c1ccc(cc1)Br 1P006ZLZ [1,1,0,0,0,0|2,0,0]=4 3100 B10R1.13 NC(=N)c1ccc(cc1)C 1P00IBNC [1,1,0,0,0,0|2,0,0]=4 3101 B10R1.13 NC(=N)c1ccc(cc1)Cl 1P001J9E [1,1,0,0,0,0|2,0,0]=4 3102 B10R1.13 NC(=N)c1ccc(cc1)Cl 1P00AP7K [1,1,0,0,0,0|2,0,0]=4 3103 B10R1.13 NC(=N)c1ccc(cc1)F 1P002NJF [1,1,0,0,0,0|2,0,0]=4 3104 B10R1.13 NC(=N)c1ccc(cc1)F 1P00I8ZO [1,1,0,0,0,0|2,0,0]=4 3105 B10R1.13 NC(=N)c1ccc(cc1)I 1P009GFR [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.13 NC(=N)c1ccc(cc1)O 1P0034IQ [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] 1P0079PZ [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.13 NC(=O)c1ccc(cc1)Br 1P00FARZ [1,1,0,0,0,0|1,0,0]=3 3109 B10R1.13 NC(=O)c1ccc(cc1)C 1P003UHI [1,1,0,0,0,0|1,0,0]=3 3110 B10R1.13 NC(=O)c1ccc(cc1)Cl 1P00IBEI [1,1,0,0,0,0|1,0,0]=3 3111 B10R1.13 NC(=O)c1ccc(cc1)F 1P003LVJ [1,1,0,0,0,0|1,0,0]=3 3112 B10R1.13 NC(=O)c1ccc(cc1)I 1P003M19 [1,1,0,0,0,0|1,0,0]=3 3113 B10R1.13 NC(=O)c1ccc(cc1)O 1P0018KP [1,1,0,0,0,0|1,0,0]=3 3114 B10R1.13 NC(=O)c1ccc(cc1)O 1P003LZM [1,1,0,0,0,0|1,0,0]=3 3115 B10R1.13 NC(=O)c1ccc(cc1)S 1P01DWZC [1,1,0,0,0,0|1,0,0]=3 3116 B10R1.13 NC(=S)c1ccc(cc1)Br 1P002SP4 [1,1,0,0,0,0|1,1,0]=4 3117 B10R1.13 NC(=S)c1ccc(cc1)C 1P002OEQ [1,1,0,0,0,0|1,1,0]=4 3118 B10R1.13 NC(=S)c1ccc(cc1)Cl 1P002REP [1,1,0,0,0,0|1,1,0]=4 3119 B10R1.13 NC(=S)c1ccc(cc1)F 1P00709Q [1,1,0,0,0,0|1,1,0]=4 3120 B10R1.13 NC(=S)c1ccc(cc1)O 1P003M0N [1,1,0,0,0,0|1,1,0]=4 3121 B10R1.13 N[13c]1[13cH][13cH][13c]([13cH][13cH]1)[N+](=O)[O-] 1P0201H6 [1,1,0,0,0,0|1,0,1]=4 3122 B10R1.13 Nc1ccc(cc1)C(=N)N 1P002QJF [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.13 Nc1ccc(cc1)C(=N)N 1P005T2T [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.13 Nc1ccc(cc1)C(=O)N 1P003L7G [1,1,0,0,0,0|1,0,0]=3 3125 B10R1.13 Nc1ccc(cc1)C(=S)N 1P003L8W [1,1,0,0,0,0|1,1,0]=4 3126 B10R1.13 Nc1ccc(cc1)S(=O)C 1P00BI2O [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] 1P001RAJ [1,1,0,0,0,0|1,0,1]=4 3128 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] 1P0034KZ [1,1,0,0,0,0|1,0,1]=4 3129 B10R1.13 Nc1ccc(cn1)C(=O)C 1P002BVW [1,1,0,0,0,0|2,0,0]=4 3130 B10R1.13 Nc1ccc(cn1)C(=O)N 1P003NJJ [1,1,0,0,0,0|2,0,0]=4 3131 B10R1.13 Nc1ccc(cn1)C(=O)O 1P003NJP [1,1,0,0,0,0|1,0,0]=3 3132 B10R1.13 Nc1ccc(nc1)C(=O)C 1P00DIDZ [1,1,0,0,0,0|2,0,0]=4 3133 B10R1.13 Nc1ccc(nc1)C(=O)N 1P001L6V [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.13 Nc1ccc(nc1)C(=O)O 1P0034NI [1,1,0,0,0,0|1,0,0]=3 3135 B10R1.13 Nc1ccc(nc1)C(=O)O 1P005NVH [1,1,0,0,0,0|1,0,0]=3 3136 B10R1.13 Nc1ccc(nn1)C(=O)O 1P003NJO [1,1,0,0,0,0|2,0,0]=4 3137 B10R1.13 Nc1cnc(cn1)C(=O)O 1P003MV9 [1,1,0,0,0,0|2,0,0]=4 3138 B10R1.13 O=[S-](=O)c1ccc(cc1)C 1P00E5RU [1,1,0,0,0,0|1,0,1]=4 3139 B10R1.13 O=c1ccc(co1)C(=O)O 1P006X98 [1,1,0,0,0,0|1,0,0]=3 3140 B10R1.13 OB(c1ccc(cc1)Br)O 1P003LHN [1,1,0,0,0,0|1,0,1]=4 3141 B10R1.13 OB(c1ccc(cc1)C)O 1P0034M9 [1,1,0,0,0,0|1,0,1]=4 3142 B10R1.13 OB(c1ccc(cc1)Cl)O 1P0034GY [1,1,0,0,0,0|1,0,1]=4 3143 B10R1.13 OB(c1ccc(cc1)F)O 1P00256J [1,1,0,0,0,0|1,0,1]=4 3144 B10R1.13 OB(c1ccc(cc1)I)O 1P0034JL [1,1,0,0,0,0|1,0,1]=4 3145 B10R1.13 OB(c1ccc(cc1)N)O 1P003L7J [1,1,0,0,0,0|1,0,1]=4 3146 B10R1.13 OB(c1ccc(cc1)N)O 1P00897W [1,1,0,0,0,0|1,0,1]=4 3147 B10R1.13 OB(c1ccc(cc1)S)O 1P00I51V [1,1,0,0,0,0|1,0,1]=4 3148 B10R1.13 OC(=O)c1c[nH]c(=O)cn1 1P005PT2 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.13 OC(=O)c1cc[n+](cc1)[O-] 1P003UJ9 [1,1,0,0,0,0|1,0,0]=3 3150 B10R1.13 OC(=O)c1ccc(=O)[nH]c1 1P003NPH [1,1,0,0,0,0|1,0,0]=3 3151 B10R1.13 OC(=O)c1ccc(=S)[nH]c1 1P0024ZV [1,1,0,0,0,0|1,0,0]=3 3152 B10R1.13 OC(=O)c1ccc(cc1)Br 1P0034ET [1,1,0,0,0,0|0,0,0]=2 3153 B10R1.13 OC(=O)c1ccc(cc1)C 1P003MJ8 [1,1,0,0,0,0|0,0,0]=2 3154 B10R1.13 OC(=O)c1ccc(cc1)Cl 1P003LNA [1,1,0,0,0,0|0,0,0]=2 3155 B10R1.13 OC(=O)c1ccc(cc1)F 1P0034I1 [1,1,0,0,0,0|0,0,0]=2 3156 B10R1.13 OC(=O)c1ccc(cc1)I 1P003M1C [1,1,0,0,0,0|0,0,0]=2 3157 B10R1.13 OC(=O)c1ccc(cc1)N 1P0034D8 [1,1,0,0,0,0|0,0,0]=2 3158 B10R1.13 OC(=O)c1ccc(cc1)N 1P00BC4F [1,1,0,0,0,0|0,0,0]=2 3159 B10R1.13 OC(=O)c1ccc(cc1)S 1P0034JT [1,1,0,0,0,0|0,0,0]=2 3160 B10R1.13 OC(=O)c1ccc(nn1)Br 1P00EGCW [1,1,0,0,0,0|2,0,0]=4 3161 B10R1.13 OC(=O)c1ccc(nn1)Cl 1P0034TJ [1,1,0,0,0,0|2,0,0]=4 3162 B10R1.13 OC(=O)c1cnc(cn1)Br 1P004M79 [1,1,0,0,0,0|2,0,0]=4 3163 B10R1.13 OC(=O)c1cnc(cn1)Cl 1P003N5F [1,1,0,0,0,0|2,0,0]=4 3164 B10R1.13 OC(=O)c1cnc(cn1)S 1P028V4X [1,1,0,0,0,0|2,0,0]=4 3165 B10R1.13 OC(=O)c1cnc(nc1)Br 1P00HH7H [1,1,0,0,0,0|2,0,0]=4 3166 B10R1.13 OC(=O)c1cnc(nc1)C 1P003I72 [1,1,0,0,0,0|2,0,0]=4 3167 B10R1.13 OC(=O)c1cnc(nc1)Cl 1P00BZDR [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.13 OC(=O)c1cnc(nc1)N 1P0033L5 [1,1,0,0,0,0|2,0,0]=4 3169 B10R1.13 OC(=O)c1cnc(nc1)S 1P028GK8 [1,1,0,0,0,0|2,0,0]=4 3170 B10R1.13 OC(=O)c1ncc(cn1)Br 1P003N1M [1,1,0,0,0,0|2,0,0]=4 3171 B10R1.13 OC(=O)c1ncc(cn1)C 1P006OOY [1,1,0,0,0,0|2,0,0]=4 3172 B10R1.13 OC(=O)c1ncc(cn1)Cl 1P007B7F [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.13 OC(=O)c1ncc(cn1)F 1P000PR7 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.13 OC(=O)c1ncc(cn1)N 1P00EFVX [1,1,0,0,0,0|2,0,0]=4 3175 B10R1.13 Oc1ccc(cc1)B(O)O 1P0034J4 [1,1,0,0,0,0|1,0,1]=4 3176 B10R1.13 Oc1ccc(cc1)C(=O)O 1P0034IR [1,1,0,0,0,0|0,0,0]=2 3177 B10R1.13 Oc1ccc(cc1)C(O)C 1P00BCJG [1,1,0,0,0,0|1,0,1]=4 3178 B10R1.13 Oc1ccc(cc1)[C@@H](O)C 1P01AV7H [1,1,0,0,0,0|1,0,1]=4 3179 B10R1.13 Oc1ccc(cc1)[C@H](O)C 1P01AV7P [1,1,0,0,0,0|1,0,1]=4 3180 B10R1.13 Oc1ccc(cn1)C(=O)C 1P008ZI1 [1,1,0,0,0,0|2,0,0]=4 3181 B10R1.13 Oc1ccc(cn1)C(=O)N 1P00C74F [1,1,0,0,0,0|2,0,0]=4 3182 B10R1.13 Oc1ccc(nc1)C(=O)C 1P00FGUG [1,1,0,0,0,0|2,0,0]=4 3183 B10R1.13 Oc1ccc(nc1)C(=O)N 1P003WOP [1,1,0,0,0,0|2,0,0]=4 3184 B10R1.13 Oc1ccc(nc1)C(=O)O 1P000PO9 [1,1,0,0,0,0|1,0,0]=3 3185 B10R1.13 Oc1ccc(nc1)C(=O)O 1P001N9V [1,1,0,0,0,0|1,0,0]=3 3186 B10R1.13 Oc1ccc(nc1)C(=O)O 1P01DLAX [1,1,0,0,0,0|1,0,0]=3 3187 B10R1.13 Oc1ccc(nn1)C(=O)O 1P003NP6 [1,1,0,0,0,0|2,0,0]=4 3188 B10R1.13 Oc1ccc(nn1)C(=O)O 1P003NP7 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.13 Oc1ccc(nn1)C(=O)O 1P01D9LI [1,1,0,0,0,0|2,0,0]=4 3190 B10R1.13 Oc1cnc(cn1)C(=O)O 1P00BZZO [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.13 Oc1ncc(cn1)C(=O)O 1P00BYY1 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.13 Sc1ccc(cc1)[N+](=O)[O-] 1P003MDH [1,1,0,0,0,0|1,0,1]=4 3193 B10R1.13 Sc1ccc(cn1)C(=O)O 1P003NPT [1,1,0,0,0,0|1,0,0]=3 3194 B10R1.13 Sc1ccc(nc1)C(=O)O 1P028GIB [1,1,0,0,0,0|1,0,0]=3 3195 B10R1.13 [O-]C(=O)c1ccc(cc1)F 1P00DA0O [1,1,0,0,0,0|0,0,1]=3 3196 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P00189I [1,1,0,0,0,0|0,0,1]=3 3197 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P001LZJ [1,1,0,0,0,0|0,0,1]=3 3198 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P003L7N [1,1,0,0,0,0|0,0,1]=3 3199 B10R1.13 [O-]C(=O)c1ccc(cc1)O 1P000AQV [1,1,0,0,0,0|0,0,1]=3 3200 B10R1.13 [O-]c1ccc(cc1)[N+](=O)[O-] 1P003MCD [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.15 BrCC(=C)c1ccccc1 1P00BYL9 [1,1,0,0,0,0|2,0,0]=4 3202 B10R1.15 BrCC(=O)c1ccccc1 1P0033MP [1,1,0,0,0,0|1,0,0]=3 3203 B10R1.15 BrCC(=O)c1ccccn1 1P0021LH [1,1,0,0,0,0|2,0,0]=4 3204 B10R1.15 BrCC(=O)c1cccnc1 1P0025H6 [1,1,0,0,0,0|2,0,0]=4 3205 B10R1.15 BrCC(=O)c1cccnc1 1P00EJUC [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.15 BrCC(=O)c1ccncc1 1P00DETO [1,1,0,0,0,0|2,0,0]=4 3207 B10R1.15 BrCC(c1ccccc1)O 1P00C2FF [1,1,0,0,0,0|1,0,1]=4 3208 B10R1.15 C#CC(=O)c1ccccc1 1P003F2Q [1,1,0,0,0,0|1,0,0]=3 3209 B10R1.15 C=CC(=O)c1ccccc1 1P003A5I [1,1,0,0,0,0|1,0,0]=3 3210 B10R1.15 C=CC(c1ccccc1)O 1P00DKHX [1,1,0,0,0,0|1,0,1]=4 3211 B10R1.15 C=CS(=O)c1ccccc1 1P0029ZV [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.15 CC=C(c1ccccc1)C 1P002K1A [1,1,0,0,0,0|2,0,0]=4 3213 B10R1.15 CCC(=C)c1ccccc1 1P0029NW [1,1,0,0,0,0|2,0,0]=4 3214 B10R1.15 CCC(=O)c1ccccc1 1P003UGA [1,1,0,0,0,0|1,0,0]=3 3215 B10R1.15 CCC(=O)c1ccccn1 1P0033WA [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.15 CCC(=O)c1cccnc1 1P003KCR [1,1,0,0,0,0|2,0,0]=4 3217 B10R1.15 CCC(=O)c1ccncc1 1P003DKY [1,1,0,0,0,0|2,0,0]=4 3218 B10R1.15 CCC(=O)c1ccncc1 1P028X9W [1,1,0,0,0,0|2,0,0]=4 3219 B10R1.15 CC[C@@H](c1ccccc1)O 1P003CTX [1,1,0,0,0,0|1,0,1]=4 3220 B10R1.15 CC[C@H](c1ccccc1)O 1P003CLI [1,1,0,0,0,0|1,0,1]=4 3221 B10R1.15 CNC(=N)c1ccccc1 1P01BBOA [1,1,0,0,0,0|2,0,0]=4 3222 B10R1.15 CNC(=O)c1ccccc1 1P003TNT [1,1,0,0,0,0|1,0,0]=3 3223 B10R1.15 CNC(=O)c1ccccn1 1P00EFMA [1,1,0,0,0,0|2,0,0]=4 3224 B10R1.15 CNC(=O)c1cccnc1 1P000AQ4 [1,1,0,0,0,0|2,0,0]=4 3225 B10R1.15 CNC(=S)c1ccccc1 1P00E16P [1,1,0,0,0,0|1,1,0]=4 3226 B10R1.15 COC(=N)c1ccccc1 1P003SG1 [1,1,0,0,0,0|1,0,0]=3 3227 B10R1.15 COC(=O)c1ccccc1 1P00IHWQ [1,1,0,0,0,0|0,0,0]=2 3228 B10R1.15 COC(=O)c1ccccn1 1P002P5B [1,1,0,0,0,0|1,0,0]=3 3229 B10R1.15 COC(=O)c1cccnc1 1P003SI1 [1,1,0,0,0,0|1,0,0]=3 3230 B10R1.15 COC(=O)c1cccnn1 1P00C82F [1,1,0,0,0,0|2,0,0]=4 3231 B10R1.15 COC(=O)c1ccncc1 1P002P5A [1,1,0,0,0,0|1,0,0]=3 3232 B10R1.15 COC(=O)c1ccncn1 1P002OTR [1,1,0,0,0,0|2,0,0]=4 3233 B10R1.15 COC(=O)c1ccnnc1 1P003SJ5 [1,1,0,0,0,0|2,0,0]=4 3234 B10R1.15 COC(=O)c1cnccn1 1P003SJ3 [1,1,0,0,0,0|2,0,0]=4 3235 B10R1.15 COC(=O)c1cnccn1 1P0287C0 [1,1,0,0,0,0|2,0,0]=4 3236 B10R1.15 COC(=O)c1cncnc1 1P0036JN [1,1,0,0,0,0|2,0,0]=4 3237 B10R1.15 COC(=O)c1ncccn1 1P003IDX [1,1,0,0,0,0|2,0,0]=4 3238 B10R1.15 COS(=O)c1ccccc1 1P0035P8 [1,1,0,0,0,0|1,0,0]=3 3239 B10R1.15 CSC(=S)c1ccccc1 1P007PX1 [1,1,0,0,0,0|0,2,0]=4 3240 B10R1.15 ClCC(=O)c1ccccn1 1P00DTRX [1,1,0,0,0,0|2,0,0]=4 3241 B10R1.15 ClCC(=O)c1cccnc1 1P00E9NE [1,1,0,0,0,0|2,0,0]=4 3242 B10R1.15 ClCC(=O)c1ccncc1 1P007OBO [1,1,0,0,0,0|2,0,0]=4 3243 B10R1.15 ClCS(=O)c1ccccc1 1P003BRN [1,1,0,0,0,0|2,0,0]=4 3244 B10R1.15 ClC[C@@H](c1ccccc1)O 1P003CPP [1,1,0,0,0,0|1,0,1]=4 3245 B10R1.15 ClC[C@H](c1ccccc1)O 1P003CX6 [1,1,0,0,0,0|1,0,1]=4 3246 B10R1.15 FCC(=O)c1ccccc1 1P00I8Y0 [1,1,0,0,0,0|1,0,0]=3 3247 B10R1.15 FCC(=O)c1ccccn1 1P00GPM5 [1,1,0,0,0,0|2,0,0]=4 3248 B10R1.15 FCC(c1ccccc1)O 1P00DZT3 [1,1,0,0,0,0|1,0,1]=4 3249 B10R1.15 FC[C@@H](c1ccccc1)O 1P0290ZI [1,1,0,0,0,0|1,0,1]=4 3250 B10R1.15 FC[C@H](c1ccccc1)O 1P023OF9 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.15 N#CC(=O)c1ccccc1 1P003OJN [1,1,0,0,0,0|1,0,0]=3 3252 B10R1.15 NCC(=C)c1ccccc1 1P019VHO [1,1,0,0,0,0|2,0,0]=4 3253 B10R1.15 NCC(=O)c1ccccc1 1P007ACW [1,1,0,0,0,0|1,0,0]=3 3254 B10R1.15 NCC(=O)c1ccccc1 1P00IA8E [1,1,0,0,0,0|1,0,0]=3 3255 B10R1.15 NCC(=O)c1ccccn1 1P00DIEH [1,1,0,0,0,0|2,0,0]=4 3256 B10R1.15 NCC(=O)c1cccnc1 1P00DFSO [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.15 NCC(=O)c1ccncc1 1P00DIEI [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.15 NCC(c1ccccc1)O 1P003GT0 [1,1,0,0,0,0|1,0,1]=4 3259 B10R1.15 NC[C@@H](c1ccccc1)O 1P003BFB [1,1,0,0,0,0|1,0,1]=4 3260 B10R1.15 NC[C@@H](c1ccccc1)O 1P00AQ4Y [1,1,0,0,0,0|1,0,1]=4 3261 B10R1.15 NC[C@H](c1ccccc1)O 1P003CUG [1,1,0,0,0,0|1,0,1]=4 3262 B10R1.15 NNC(=N)c1ccccc1 1P002X41 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.15 NNC(=O)c1ccccc1 1P003OJR [1,1,0,0,0,0|1,0,0]=3 3264 B10R1.15 NNC(=O)c1ccccn1 1P003BQA [1,1,0,0,0,0|2,0,0]=4 3265 B10R1.15 NNC(=O)c1cccnc1 1P003TKF [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.15 NNC(=O)c1ccncc1 1P00IA3Q [1,1,0,0,0,0|2,0,0]=4 3267 B10R1.15 NNC(=S)c1ccccc1 1P002AZ4 [1,1,0,0,0,0|1,1,0]=4 3268 B10R1.15 NOC(c1ccccc1)C 1P01BCFB [1,1,0,0,0,0|1,0,1]=4 3269 B10R1.15 NOC(c1ccccc1)C 1P01BCKY [1,1,0,0,0,0|1,0,1]=4 3270 B10R1.15 NO[C@@H](c1ccccc1)C 1P01FJN9 [1,1,0,0,0,0|1,0,1]=4 3271 B10R1.15 NO[C@H](c1ccccc1)C 1P01B4DC [1,1,0,0,0,0|1,0,1]=4 3272 B10R1.15 O=CC(=O)c1ccccc1 1P0035XU [1,1,0,0,0,0|0,0,1]=3 3273 B10R1.15 O=CC(=O)c1ccccc1 1P0035XV [1,1,0,0,0,0|0,0,1]=3 3274 B10R1.15 O=CC(c1ccccc1)C 1P003BQ9 [1,1,0,0,0,0|1,0,1]=4 3275 B10R1.15 O=CN(c1ccccc1)C 1P003TOE [1,1,0,0,0,0|2,0,0]=4 3276 B10R1.15 O=NN(c1ccccc1)C 1P003TPQ [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.15 O=NN(c1ccccc1)[O-] 1P00IKYS [1,1,0,0,0,0|1,0,1]=4 3278 B10R1.15 O=NN(c1ccccc1)[O-] 1P01DQLH [1,1,0,0,0,0|1,0,1]=4 3279 B10R1.15 OC(c1ccccc1)C#C 1P003F2P [1,1,0,0,0,0|1,0,1]=4 3280 B10R1.15 OC(c1ccccc1)C#N 1P0035L5 [1,1,0,0,0,0|1,0,1]=4 3281 B10R1.15 OCC(=C)c1ccccc1 1P0036LP [1,1,0,0,0,0|1,0,0]=3 3282 B10R1.15 OCC(=C)c1cccnc1 1P024ZQ7 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.15 OCC(=O)c1ccccc1 1P003HVU [1,1,0,0,0,0|0,0,0]=2 3284 B10R1.15 OCC(=O)c1ccccn1 1P01DFA8 [1,1,0,0,0,0|1,0,0]=3 3285 B10R1.15 OCC(=O)c1cccnc1 1P008Z6T [1,1,0,0,0,0|1,0,0]=3 3286 B10R1.15 OCC(c1ccccc1)C 1P003ON3 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.15 OCC(c1ccccc1)N 1P003Q9L [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.15 OCC(c1ccccc1)O 1P00IHWP [1,1,0,0,0,0|0,0,2]=4 3289 B10R1.15 OC[C@@H](c1ccccc1)C 1P002FO5 [1,1,0,0,0,0|1,0,1]=4 3290 B10R1.15 OC[C@@H](c1ccccc1)N 1P0032U7 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.15 OC[C@@H](c1ccccc1)O 1P001UOQ [1,1,0,0,0,0|0,0,2]=4 3292 B10R1.15 OC[C@H](c1ccccc1)C 1P003CUF [1,1,0,0,0,0|1,0,1]=4 3293 B10R1.15 OC[C@H](c1ccccc1)N 1P0032WQ [1,1,0,0,0,0|1,0,1]=4 3294 B10R1.15 OC[C@H](c1ccccc1)N 1P01KLDI [1,1,0,0,0,0|1,0,1]=4 3295 B10R1.15 OC[C@H](c1ccccc1)O 1P003CWM [1,1,0,0,0,0|0,0,2]=4 3296 B10R1.15 ON=C(c1ccccc1)C 1P00DMUA [1,1,0,0,0,0|1,0,0]=3 3297 B10R1.15 ON=C(c1ccccc1)Cl 1P01ACQ0 [1,1,0,0,0,0|1,0,0]=3 3298 B10R1.15 ON=C(c1ccccc1)N 1P01BA34 [1,1,0,0,0,0|1,0,0]=3 3299 B10R1.15 ON=C(c1cccnc1)Cl 1P01BDK9 [1,1,0,0,0,0|2,0,0]=4 3300 B10R1.15 ON=C(c1ccncc1)C 1P000J5V [1,1,0,0,0,0|2,0,0]=4 3301 B10R1.15 ON=C(c1ccncc1)Cl 1P00D6HI [1,1,0,0,0,0|2,0,0]=4 3302 B10R1.15 ON=C(c1ccncc1)Cl 1P01BDK6 [1,1,0,0,0,0|2,0,0]=4 3303 B10R1.15 ON=C(c1ccncc1)N 1P001R50 [1,1,0,0,0,0|2,0,0]=4 3304 B10R1.15 ONC(=N)c1ccccn1 1P0025MV [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.15 ONC(=N)c1cccnc1 1P001R4Z [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.15 ONC(=O)c1ccccc1 1P003OIX [1,1,0,0,0,0|0,0,0]=2 3307 B10R1.15 ONC(c1ccccc1)C 1P002XUP [1,1,0,0,0,0|1,0,1]=4 3308 B10R1.15 O[C@@H](c1ccccc1)C#C 1P003COU [1,1,0,0,0,0|1,0,1]=4 3309 B10R1.15 O[C@H](c1ccccc1)C#C 1P003D0N [1,1,0,0,0,0|1,0,1]=4 3310 B10R1.15 O[C@H](c1ccccc1)C#N 1P0001PU [1,1,0,0,0,0|1,0,1]=4 3311 B10R1.15 O\N=C(/c1cccnc1)\C 1P00EA84 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.15 O\N=C(/c1ccncc1)\C 1P009O8D [1,1,0,0,0,0|2,0,0]=4 3313 B10R1.15 O\N=C(\c1ccccc1)/C 1P003O45 [1,1,0,0,0,0|1,0,0]=3 3314 B10R1.15 O\N=C(\c1ccccc1)/Cl 1P00FAE8 [1,1,0,0,0,0|1,0,0]=3 3315 B10R1.15 O\N=C(\c1ccccc1)/N 1P003OH7 [1,1,0,0,0,0|1,0,0]=3 3316 B10R1.15 O\N=C(\c1ccccc1)/N 1P009A68 [1,1,0,0,0,0|1,0,0]=3 3317 B10R1.15 O\N=C(\c1ccccn1)/C 1P00GPLO [1,1,0,0,0,0|2,0,0]=4 3318 B10R1.15 O\N=C(\c1ccccn1)/Cl 1P005V6E [1,1,0,0,0,0|2,0,0]=4 3319 B10R1.15 O\N=C(\c1cccnc1)/N 1P018Z8W [1,1,0,0,0,0|2,0,0]=4 3320 B10R1.15 SCC(=O)c1ccccc1 1P00BIBD [1,1,0,0,0,0|0,1,0]=3 3321 B10R1.15 [O-]NC(=O)c1ccccc1 1P003OIY [1,1,0,0,0,0|0,0,1]=3 3322 B10R1.15 [O-]NC(=O)c1ccccc1 1P00C19F [1,1,0,0,0,0|0,0,1]=3 3323 B10R1.28 BrS(=O)(=O)c1ccccc1 1P002M7T [1,1,0,0,0,0|1,0,1]=4 3324 B10R1.28 CC(c1ccccc1)(O)C 1P003IBQ [1,1,0,0,0,0|1,0,1]=4 3325 B10R1.28 CP(=O)(c1ccccc1)C 1P01PGUE [1,1,0,0,0,0|2,0,0]=4 3326 B10R1.28 CP(=O)(c1ccccc1)Cl 1P003SKW [1,1,0,0,0,0|2,0,0]=4 3327 B10R1.28 CS(=O)(=N)c1ccccc1 1P00E023 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.28 CS(=O)(=O)c1ccccc1 1P0032MP [1,1,0,0,0,0|1,0,1]=4 3329 B10R1.28 C[S@@](=O)(=N)c1ccccc1 1P003CYS [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.28 C[Si](c1ccccc1)(O)C 1P003Q46 [1,1,0,0,0,0|1,1,0]=4 3331 B10R1.28 ClP(=O)(c1ccccc1)Cl 1P0036VZ [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.28 ClS(=O)(=O)c1ccccc1 1P001UZA [1,1,0,0,0,0|1,0,1]=4 3333 B10R1.28 ClS(=O)(=O)c1ccccc1 1P003OHS [1,1,0,0,0,0|1,0,1]=4 3334 B10R1.28 FS(=O)(=O)c1ccccc1 1P003OHV [1,1,0,0,0,0|1,0,1]=4 3335 B10R1.28 IS(=O)(=O)c1ccccc1 1P028OQQ [1,1,0,0,0,0|1,0,1]=4 3336 B10R1.28 NP(=O)(c1ccccc1)N 1P00DT3N [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.28 NS(=O)(=O)c1ccccc1 1P0034YD [1,1,0,0,0,0|1,0,1]=4 3338 B10R1.28 O=S(C1=CC=CC=C1)(N)=N 1P01K4LQ [1,1,0,0,0,0|2,0,0]=4 3339 B10R1.28 OP(=O)(c1ccccc1)O 1P001POC [1,1,0,0,0,0|1,0,0]=3 3340 B10R1.28 OS(=O)(=O)c1ccccc1 1P002SCX [1,1,0,0,0,0|1,0,0]=3 3341 B10R1.28 OS(=O)(=O)c1ccccc1 1P003OHO [1,1,0,0,0,0|1,0,0]=3 3342 B10R1.28 OS(=O)(=O)c1ccccc1 1P003OHP [1,1,0,0,0,0|1,0,0]=3 3343 B10R1.28 OS(=O)(=O)c1ccccc1 1P00756N [1,1,0,0,0,0|1,0,0]=3 3344 B10R1.28 OS(=O)(=O)c1ccccn1 1P001NI2 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.28 OS(=O)(=O)c1cccnc1 1P00348T [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.28 OS(=O)(=O)c1ccncc1 1P00DDCT [1,1,0,0,0,0|2,0,0]=4 3347 B10R1.28 [O-]P(=O)(c1ccccc1)[O-] 1P002R3V [1,1,0,0,0,0|1,0,1]=4 3348 B10R1.28 [O-]S(=O)(=O)c1ccccc1 1P0035VA [1,1,0,0,0,0|1,0,1]=4 3349 B10R1.28 [O-]S(=O)(=O)c1ccccc1 1P003OHQ [1,1,0,0,0,0|1,0,1]=4 3350 B10R1.28 [O-]S(=S)(=O)c1ccccc1 1P002HMU [1,1,0,0,0,0|1,0,1]=4 3351 B10R1.113 Brc1cccc(c1)B(O)O 1P00343N [1,1,0,0,0,0|1,0,1]=4 3352 B10R1.113 Brc1cccc(c1)C(=C)C 1P01DFHU [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.113 Brc1cccc(c1)C(=C)F 1P01KJDN [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.113 Brc1cccc(c1)C(=N)N 1P002SCY [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.113 Brc1cccc(c1)C(=N)N 1P00385V [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.113 Brc1cccc(c1)C(=O)C 1P00343B [1,1,0,0,0,0|1,0,0]=3 3357 B10R1.113 Brc1cccc(c1)C(=O)Cl 1P003JKS [1,1,0,0,0,0|1,0,0]=3 3358 B10R1.113 Brc1cccc(c1)C(=O)N 1P003JKP [1,1,0,0,0,0|1,0,0]=3 3359 B10R1.113 Brc1cccc(c1)C(=O)O 1P00343E [1,1,0,0,0,0|0,0,0]=2 3360 B10R1.113 Brc1cccc(c1)C(=S)N 1P003JM0 [1,1,0,0,0,0|1,1,0]=4 3361 B10R1.113 Brc1cccc(c1)C(O)C 1P003DD6 [1,1,0,0,0,0|1,0,1]=4 3362 B10R1.113 Brc1cccc(c1)S(=O)C 1P00I61D [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.113 Brc1cccc(c1)S(=O)[O-] 1P0087RC [1,1,0,0,0,0|1,0,1]=4 3364 B10R1.113 Brc1cccc(c1)[C@@H](O)C 1P009B9B [1,1,0,0,0,0|1,0,1]=4 3365 B10R1.113 Brc1cccc(c1)[C@H](O)C 1P00HTTB [1,1,0,0,0,0|1,0,1]=4 3366 B10R1.113 Brc1cccc(c1)[N+](=O)[O-] 1P00IAUX [1,1,0,0,0,0|1,0,1]=4 3367 B10R1.113 Brc1cccc(n1)C(=O)C 1P003GRS [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.113 Brc1cccc(n1)C(=O)N 1P002RBC [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.113 Brc1cccc(n1)C(=O)O 1P003NLN [1,1,0,0,0,0|1,0,0]=3 3370 B10R1.113 Brc1nccc(c1)C(=O)C 1P008GLR [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.113 Brc1nccc(c1)C(=O)N 1P0037VO [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.113 Brc1nccc(c1)C(=O)O 1P003H8P [1,1,0,0,0,0|1,0,0]=3 3373 B10R1.113 Brc1nccc(n1)C(=O)O 1P00HGE4 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.113 CC(=O)c1cc(Br)ccn1 1P008X5S [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.113 CC(=O)c1cc(Br)cnc1 1P003JA1 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.113 CC(=O)c1cc(Cl)ccn1 1P00EAZB [1,1,0,0,0,0|2,0,0]=4 3377 B10R1.113 CC(=O)c1cc(Cl)cnc1 1P0096YV [1,1,0,0,0,0|2,0,0]=4 3378 B10R1.113 CC(=O)c1cc(F)cnc1 1P007HHH [1,1,0,0,0,0|2,0,0]=4 3379 B10R1.113 CC(=O)c1cc(N)ccn1 1P01FPBD [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.113 CC(=O)c1cc(O)cnc1 1P00H2TX [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.113 CC(=O)c1cc[nH]c(=O)c1 1P0087BW [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.113 C[n+]1cc(ncc1)C(=O)O 1P01F00X [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.113 C[n+]1cccc(c1)C(=O)N 1P0002MF [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.113 C[n+]1cccc(c1)C(=O)O 1P003VJ9 [1,1,0,0,0,0|1,0,0]=3 3385 B10R1.113 C[n+]1cccc(c1)C(=O)[O-] 1P003A9A [1,1,0,0,0,0|1,0,1]=4 3386 B10R1.113 Cc1cc(cnc1)C(=O)N 1P003ND0 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.113 Cc1cc(cnc1)C(=O)O 1P003ND1 [1,1,0,0,0,0|1,0,0]=3 3388 B10R1.113 Cc1cc(cnn1)C(=O)O 1P00HCMQ [1,1,0,0,0,0|2,0,0]=4 3389 B10R1.113 Cc1cc(cnn1)C(=O)O 1P01AGKY [1,1,0,0,0,0|2,0,0]=4 3390 B10R1.113 Cc1cc(ncc1)C(=O)O 1P0036FE [1,1,0,0,0,0|1,0,0]=3 3391 B10R1.113 Cc1cc(ncn1)C(=O)O 1P0019VD [1,1,0,0,0,0|2,0,0]=4 3392 B10R1.113 Cc1cc(ncn1)C(=O)O 1P0293TC [1,1,0,0,0,0|2,0,0]=4 3393 B10R1.113 Cc1cccc(c1)B(O)O 1P0027EH [1,1,0,0,0,0|1,0,1]=4 3394 B10R1.113 Cc1cccc(c1)C(=C)C 1P003RUW [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.113 Cc1cccc(c1)C(=N)N 1P002J5B [1,1,0,0,0,0|2,0,0]=4 3396 B10R1.113 Cc1cccc(c1)C(=N)N 1P0075JC [1,1,0,0,0,0|2,0,0]=4 3397 B10R1.113 Cc1cccc(c1)C(=O)C 1P00IAUW [1,1,0,0,0,0|1,0,0]=3 3398 B10R1.113 Cc1cccc(c1)C(=O)Cl 1P003SN4 [1,1,0,0,0,0|1,0,0]=3 3399 B10R1.113 Cc1cccc(c1)C(=O)N 1P003K78 [1,1,0,0,0,0|1,0,0]=3 3400 B10R1.113 Cc1cccc(c1)C(=O)O 1P003SN2 [1,1,0,0,0,0|0,0,0]=2 3401 B10R1.113 Cc1cccc(c1)C(=S)N 1P002OEP [1,1,0,0,0,0|1,1,0]=4 3402 B10R1.113 Cc1cccc(c1)C(O)C 1P00FJ2F [1,1,0,0,0,0|1,0,1]=4 3403 B10R1.113 Cc1cccc(c1)S(=O)C 1P000ZR8 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.113 Cc1cccc(c1)S(=O)[O-] 1P00ASY9 [1,1,0,0,0,0|1,0,1]=4 3405 B10R1.113 Cc1cccc(c1)[C@@H](O)C 1P00DKFI [1,1,0,0,0,0|1,0,1]=4 3406 B10R1.113 Cc1cccc(c1)[C@H](O)C 1P00CLM5 [1,1,0,0,0,0|1,0,1]=4 3407 B10R1.113 Cc1cccc(c1)[N+](=O)[O-] 1P003A3U [1,1,0,0,0,0|1,0,1]=4 3408 B10R1.113 Cc1cccc(n1)C(=O)C 1P003GRV [1,1,0,0,0,0|2,0,0]=4 3409 B10R1.113 Cc1cccc(n1)C(=O)Cl 1P00F4ND [1,1,0,0,0,0|2,0,0]=4 3410 B10R1.113 Cc1cccc(n1)C(=O)N 1P00EMDK [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.113 Cc1cccc(n1)C(=O)O 1P0034U5 [1,1,0,0,0,0|1,0,0]=3 3412 B10R1.113 Cc1ccnc(c1)C(=O)C 1P003GRN [1,1,0,0,0,0|2,0,0]=4 3413 B10R1.113 Cc1ccnc(n1)C(=O)O 1P00379X [1,1,0,0,0,0|2,0,0]=4 3414 B10R1.113 Cc1ccnc(n1)C(=O)O 1P01BGUE [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.113 Cc1cncc(c1)C(=O)C 1P00CAT8 [1,1,0,0,0,0|2,0,0]=4 3416 B10R1.113 Cc1cncc(n1)C(=O)O 1P0036OU [1,1,0,0,0,0|2,0,0]=4 3417 B10R1.113 Cc1cnnc(c1)C(=O)O 1P00HGFO [1,1,0,0,0,0|2,0,0]=4 3418 B10R1.113 Cc1nccc(c1)C(=O)C 1P00BDBG [1,1,0,0,0,0|2,0,0]=4 3419 B10R1.113 Cc1nccc(c1)C(=O)N 1P00AKYZ [1,1,0,0,0,0|2,0,0]=4 3420 B10R1.113 Cc1nccc(c1)C(=O)O 1P0033UX [1,1,0,0,0,0|1,0,0]=3 3421 B10R1.113 Cc1nccc(n1)C(=O)O 1P007N4X [1,1,0,0,0,0|2,0,0]=4 3422 B10R1.113 ClC(=O)c1cc(Br)cnc1 1P003N1C [1,1,0,0,0,0|2,0,0]=4 3423 B10R1.113 Clc1cccc(c1)B(O)O 1P00344W [1,1,0,0,0,0|1,0,1]=4 3424 B10R1.113 Clc1cccc(c1)C(=C)C 1P00ATR4 [1,1,0,0,0,0|2,0,0]=4 3425 B10R1.113 Clc1cccc(c1)C(=N)N 1P003A6F [1,1,0,0,0,0|2,0,0]=4 3426 B10R1.113 Clc1cccc(c1)C(=O)Cl 1P00F3HP [1,1,0,0,0,0|1,0,0]=3 3427 B10R1.113 Clc1cccc(c1)C(=O)N 1P00E9KT [1,1,0,0,0,0|1,0,0]=3 3428 B10R1.113 Clc1cccc(c1)C(=O)O 1P003JR5 [1,1,0,0,0,0|0,0,0]=2 3429 B10R1.113 Clc1cccc(c1)C(=S)N 1P003JSG [1,1,0,0,0,0|1,1,0]=4 3430 B10R1.113 Clc1cccc(c1)C(O)C 1P003DDG [1,1,0,0,0,0|1,0,1]=4 3431 B10R1.113 Clc1cccc(c1)S(=O)[O-] 1P01BEXC [1,1,0,0,0,0|1,0,1]=4 3432 B10R1.113 Clc1cccc(c1)[C@@H](O)C 1P009BSV [1,1,0,0,0,0|1,0,1]=4 3433 B10R1.113 Clc1cccc(c1)[C@H](O)C 1P000QTO [1,1,0,0,0,0|1,0,1]=4 3434 B10R1.113 Clc1cccc(c1)[N+](=O)[O-] 1P007Q6W [1,1,0,0,0,0|1,0,1]=4 3435 B10R1.113 Clc1cccc(n1)C(=O)C 1P00APS1 [1,1,0,0,0,0|2,0,0]=4 3436 B10R1.113 Clc1cccc(n1)C(=O)Cl 1P0055OQ [1,1,0,0,0,0|2,0,0]=4 3437 B10R1.113 Clc1cccc(n1)C(=O)N 1P0067G9 [1,1,0,0,0,0|2,0,0]=4 3438 B10R1.113 Clc1cccc(n1)C(=O)O 1P00I91Z [1,1,0,0,0,0|1,0,0]=3 3439 B10R1.113 Clc1ccnc(c1)C(=O)Cl 1P00DEPJ [1,1,0,0,0,0|2,0,0]=4 3440 B10R1.113 Clc1cncc(c1)C(=O)Cl 1P004PP2 [1,1,0,0,0,0|2,0,0]=4 3441 B10R1.113 Clc1cnnc(c1)C(=O)O 1P00A0QP [1,1,0,0,0,0|2,0,0]=4 3442 B10R1.113 Clc1nccc(c1)C(=O)C 1P003HDL [1,1,0,0,0,0|2,0,0]=4 3443 B10R1.113 Clc1nccc(c1)C(=O)Cl 1P003HJ8 [1,1,0,0,0,0|2,0,0]=4 3444 B10R1.113 Clc1nccc(c1)C(=O)N 1P0003HM [1,1,0,0,0,0|2,0,0]=4 3445 B10R1.113 Clc1nccc(c1)C(=O)O 1P003HAQ [1,1,0,0,0,0|1,0,0]=3 3446 B10R1.113 Clc1nccc(n1)C(=O)O 1P001MIA [1,1,0,0,0,0|2,0,0]=4 3447 B10R1.113 Fc1cccc(c1)B(O)O 1P00346D [1,1,0,0,0,0|1,0,1]=4 3448 B10R1.113 Fc1cccc(c1)C(=C)C 1P01AC8N [1,1,0,0,0,0|2,0,0]=4 3449 B10R1.113 Fc1cccc(c1)C(=N)N 1P00FB1F [1,1,0,0,0,0|2,0,0]=4 3450 B10R1.113 Fc1cccc(c1)C(=N)N 1P00ID2X [1,1,0,0,0,0|2,0,0]=4 3451 B10R1.113 Fc1cccc(c1)C(=O)C 1P003JXP [1,1,0,0,0,0|1,0,0]=3 3452 B10R1.113 Fc1cccc(c1)C(=O)Cl 1P00HZZM [1,1,0,0,0,0|1,0,0]=3 3453 B10R1.113 Fc1cccc(c1)C(=O)F 1P028ERF [1,1,0,0,0,0|1,0,0]=3 3454 B10R1.113 Fc1cccc(c1)C(=O)N 1P00DES0 [1,1,0,0,0,0|1,0,0]=3 3455 B10R1.113 Fc1cccc(c1)C(=O)O 1P003JXV [1,1,0,0,0,0|0,0,0]=2 3456 B10R1.113 Fc1cccc(c1)C(=O)[O-] 1P00DAE1 [1,1,0,0,0,0|0,0,1]=3 3457 B10R1.113 Fc1cccc(c1)C(=S)N 1P00FB1I [1,1,0,0,0,0|1,1,0]=4 3458 B10R1.113 Fc1cccc(c1)C(O)C 1P003DDQ [1,1,0,0,0,0|1,0,1]=4 3459 B10R1.113 Fc1cccc(c1)S(=O)[O-] 1P01BEXD [1,1,0,0,0,0|1,0,1]=4 3460 B10R1.113 Fc1cccc(c1)[C@@H](O)C 1P000TCI [1,1,0,0,0,0|1,0,1]=4 3461 B10R1.113 Fc1cccc(c1)[C@H](O)C 1P000TDQ [1,1,0,0,0,0|1,0,1]=4 3462 B10R1.113 Fc1cccc(c1)[N+](=O)[O-] 1P003ESO [1,1,0,0,0,0|1,0,1]=4 3463 B10R1.113 Fc1cccc(n1)C(=O)C 1P006WGK [1,1,0,0,0,0|2,0,0]=4 3464 B10R1.113 Fc1cccc(n1)C(=O)N 1P00C7F7 [1,1,0,0,0,0|2,0,0]=4 3465 B10R1.113 Fc1cccc(n1)C(=O)O 1P003HSX [1,1,0,0,0,0|1,0,0]=3 3466 B10R1.113 Fc1nccc(c1)C(=O)C 1P008RVB [1,1,0,0,0,0|2,0,0]=4 3467 B10R1.113 Fc1nccc(c1)C(=O)Cl 1P00EEA5 [1,1,0,0,0,0|2,0,0]=4 3468 B10R1.113 Fc1nccc(c1)C(=O)N 1P01A8DW [1,1,0,0,0,0|2,0,0]=4 3469 B10R1.113 Fc1nccc(c1)C(=O)O 1P003HSL [1,1,0,0,0,0|1,0,0]=3 3470 B10R1.113 Ic1cccc(c1)B(O)O 1P00I4SU [1,1,0,0,0,0|1,0,1]=4 3471 B10R1.113 Ic1cccc(c1)C(=O)C 1P001K5K [1,1,0,0,0,0|1,0,0]=3 3472 B10R1.113 Ic1cccc(c1)C(=O)Cl 1P003K2B [1,1,0,0,0,0|1,0,0]=3 3473 B10R1.113 Ic1cccc(c1)C(=O)N 1P0085PW [1,1,0,0,0,0|1,0,0]=3 3474 B10R1.113 Ic1cccc(c1)C(=O)O 1P003K29 [1,1,0,0,0,0|0,0,0]=2 3475 B10R1.113 Ic1cccc(c1)C(=S)N 1P007C9W [1,1,0,0,0,0|1,1,0]=4 3476 B10R1.113 Ic1cccc(c1)C(O)C 1P024HK1 [1,1,0,0,0,0|1,0,1]=4 3477 B10R1.113 Ic1cccc(c1)[N+](=O)[O-] 1P003395 [1,1,0,0,0,0|1,0,1]=4 3478 B10R1.113 Ic1cccc(n1)C(=O)O 1P00IAAK [1,1,0,0,0,0|1,0,0]=3 3479 B10R1.113 Ic1nccc(c1)C(=O)N 1P00C2N5 [1,1,0,0,0,0|2,0,0]=4 3480 B10R1.113 Ic1nccc(c1)C(=O)O 1P0033TU [1,1,0,0,0,0|1,0,0]=3 3481 B10R1.113 NC(=O)c1cc(Br)ccn1 1P00ECYG [1,1,0,0,0,0|2,0,0]=4 3482 B10R1.113 NC(=O)c1cc(Br)cnc1 1P002WR4 [1,1,0,0,0,0|2,0,0]=4 3483 B10R1.113 NC(=O)c1cc(Cl)ccn1 1P003LP2 [1,1,0,0,0,0|2,0,0]=4 3484 B10R1.113 NC(=O)c1cc(Cl)cnc1 1P00C4C5 [1,1,0,0,0,0|2,0,0]=4 3485 B10R1.113 NC(=O)c1cc(F)cnc1 1P003N8D [1,1,0,0,0,0|2,0,0]=4 3486 B10R1.113 NC(=O)c1cc(O)cnc1 1P000550 [1,1,0,0,0,0|2,0,0]=4 3487 B10R1.113 NC1C=CC=C(C1)C(=O)O 1P00EBRR [1,1,0,0,0,0|0,0,2]=4 3488 B10R1.113 Nc1cc(cnc1)C(=O)O 1P003MV4 [1,1,0,0,0,0|1,0,0]=3 3489 B10R1.113 Nc1cc(cnn1)C(=O)O 1P000M84 [1,1,0,0,0,0|2,0,0]=4 3490 B10R1.113 Nc1cc(ncc1)C(=O)O 1P00014A [1,1,0,0,0,0|1,0,0]=3 3491 B10R1.113 Nc1cc(ncc1)C(=O)O 1P000ZD8 [1,1,0,0,0,0|1,0,0]=3 3492 B10R1.113 Nc1cc(ncc1)C(=O)O 1P003L8Q [1,1,0,0,0,0|1,0,0]=3 3493 B10R1.113 Nc1cccc(c1)B(O)O 1P002J1A [1,1,0,0,0,0|1,0,1]=4 3494 B10R1.113 Nc1cccc(c1)B(O)O 1P0030J9 [1,1,0,0,0,0|1,0,1]=4 3495 B10R1.113 Nc1cccc(c1)B(O)O 1P004TVA [1,1,0,0,0,0|1,0,1]=4 3496 B10R1.113 Nc1cccc(c1)B(O)O 1P00FHXI [1,1,0,0,0,0|1,0,1]=4 3497 B10R1.113 Nc1cccc(c1)C(=C)C 1P01CAQU [1,1,0,0,0,0|2,0,0]=4 3498 B10R1.113 Nc1cccc(c1)C(=N)N 1P003JDV [1,1,0,0,0,0|2,0,0]=4 3499 B10R1.113 Nc1cccc(c1)C(=O)C 1P003JDU [1,1,0,0,0,0|1,0,0]=3 3500 B10R1.113 Nc1cccc(c1)C(=O)N 1P0037SS [1,1,0,0,0,0|1,0,0]=3 3501 B10R1.113 Nc1cccc(c1)C(=O)O 1P003421 [1,1,0,0,0,0|0,0,0]=2 3502 B10R1.113 Nc1cccc(c1)C(=O)O 1P003JDW [1,1,0,0,0,0|0,0,0]=2 3503 B10R1.113 Nc1cccc(c1)C(=O)O 1P003JDX [1,1,0,0,0,0|0,0,0]=2 3504 B10R1.113 Nc1cccc(c1)C(=S)N 1P005DAW [1,1,0,0,0,0|1,1,0]=4 3505 B10R1.113 Nc1cccc(c1)C(O)C 1P002OXT [1,1,0,0,0,0|1,0,1]=4 3506 B10R1.113 Nc1cccc(c1)S(=O)C 1P019WQF [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.113 Nc1cccc(c1)S(=O)C 1P01APKC [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.113 Nc1cccc(c1)[C@@H](O)C 1P01DZPI [1,1,0,0,0,0|1,0,1]=4 3509 B10R1.113 Nc1cccc(c1)[C@H](O)C 1P01EMV6 [1,1,0,0,0,0|1,0,1]=4 3510 B10R1.113 Nc1cccc(c1)[N+](=O)[O-] 1P003A52 [1,1,0,0,0,0|1,0,1]=4 3511 B10R1.113 Nc1cccc(c1)[N+](=O)[O-] 1P003K9M [1,1,0,0,0,0|1,0,1]=4 3512 B10R1.113 Nc1cccc(n1)C(=O)C 1P0096CI [1,1,0,0,0,0|2,0,0]=4 3513 B10R1.113 Nc1cccc(n1)C(=O)N 1P009WEN [1,1,0,0,0,0|2,0,0]=4 3514 B10R1.113 Nc1cccc(n1)C(=O)O 1P002OE4 [1,1,0,0,0,0|1,0,0]=3 3515 B10R1.113 Nc1ccnc(c1)C(=O)N 1P0001IS [1,1,0,0,0,0|2,0,0]=4 3516 B10R1.113 Nc1ccnc(n1)C(=O)O 1P006479 [1,1,0,0,0,0|2,0,0]=4 3517 B10R1.113 Nc1cncc(c1)C(=O)N 1P003MV3 [1,1,0,0,0,0|2,0,0]=4 3518 B10R1.113 Nc1cncc(n1)C(=O)O 1P003NJM [1,1,0,0,0,0|2,0,0]=4 3519 B10R1.113 Nc1nccc(c1)C(=O)C 1P00CL4F [1,1,0,0,0,0|2,0,0]=4 3520 B10R1.113 Nc1nccc(c1)C(=O)N 1P0033K1 [1,1,0,0,0,0|2,0,0]=4 3521 B10R1.113 Nc1nccc(c1)C(=O)O 1P003H05 [1,1,0,0,0,0|1,0,0]=3 3522 B10R1.113 Nc1nccc(c1)C(=O)O 1P00J1XX [1,1,0,0,0,0|1,0,0]=3 3523 B10R1.113 Nc1nccc(n1)C(=O)O 1P003H0P [1,1,0,0,0,0|2,0,0]=4 3524 B10R1.113 O=C1N=CC=C(C1)C(=O)O 1P00HZQT [1,1,0,0,0,0|1,0,1]=4 3525 B10R1.113 O=c1cc[nH]c(c1)C(=O)O 1P00IKJ5 [1,1,0,0,0,0|1,0,0]=3 3526 B10R1.113 O=c1cccc(o1)C(=O)O 1P005Q2O [1,1,0,0,0,0|1,0,0]=3 3527 B10R1.113 O=c1ccoc(c1)C(=O)O 1P003PI6 [1,1,0,0,0,0|1,0,0]=3 3528 B10R1.113 O=c1nc[nH]c(c1)C(=O)O 1P003NSD [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.113 O=n1cccc(c1)C(=O)O 1P003TKE [1,1,0,0,0,0|1,0,0]=3 3530 B10R1.113 OC(=O)c1cc(=N)[nH]cn1 1P00C0WV [1,1,0,0,0,0|2,0,0]=4 3531 B10R1.113 OC(=O)c1cc(Br)ccn1 1P0031O8 [1,1,0,0,0,0|1,0,0]=3 3532 B10R1.113 OC(=O)c1cc(Br)cnc1 1P002K2H [1,1,0,0,0,0|1,0,0]=3 3533 B10R1.113 OC(=O)c1cc(Br)nnc1 1P01RLDG [1,1,0,0,0,0|2,0,0]=4 3534 B10R1.113 OC(=O)c1cc(Cl)ccn1 1P003LP3 [1,1,0,0,0,0|1,0,0]=3 3535 B10R1.113 OC(=O)c1cc(Cl)cnc1 1P007ONC [1,1,0,0,0,0|1,0,0]=3 3536 B10R1.113 OC(=O)c1cc(Cl)ncn1 1P00C7DL [1,1,0,0,0,0|2,0,0]=4 3537 B10R1.113 OC(=O)c1cc(Cl)nnc1 1P000OTO [1,1,0,0,0,0|2,0,0]=4 3538 B10R1.113 OC(=O)c1cc(F)ccn1 1P003A14 [1,1,0,0,0,0|1,0,0]=3 3539 B10R1.113 OC(=O)c1cc(F)cnc1 1P0034QK [1,1,0,0,0,0|1,0,0]=3 3540 B10R1.113 OC(=O)c1cc(I)ccn1 1P00I8FB [1,1,0,0,0,0|1,0,0]=3 3541 B10R1.113 OC(=O)c1cc(I)cnc1 1P00AKQU [1,1,0,0,0,0|1,0,0]=3 3542 B10R1.113 OC(=O)c1cc(S)cnc1 1P01C2E3 [1,1,0,0,0,0|1,0,0]=3 3543 B10R1.113 OC(=O)c1cc[nH]c(=S)c1 1P0039DI [1,1,0,0,0,0|1,0,0]=3 3544 B10R1.113 OC(=O)c1cccc(=O)[nH]1 1P003NP5 [1,1,0,0,0,0|1,0,0]=3 3545 B10R1.113 OC(=O)c1cccc(=S)[nH]1 1P001F54 [1,1,0,0,0,0|1,0,0]=3 3546 B10R1.113 OC(=O)c1ccnc(=O)[nH]1 1P0069K5 [1,1,0,0,0,0|2,0,0]=4 3547 B10R1.113 OC(=O)c1cn[nH]c(=O)c1 1P0038UN [1,1,0,0,0,0|2,0,0]=4 3548 B10R1.113 OC(=O)c1cncc(=O)[nH]1 1P001B0Z [1,1,0,0,0,0|2,0,0]=4 3549 B10R1.113 OC(=O)c1cncc(n1)Br 1P000PR6 [1,1,0,0,0,0|2,0,0]=4 3550 B10R1.113 OC(=O)c1cncc(n1)Cl 1P002OLN [1,1,0,0,0,0|2,0,0]=4 3551 B10R1.113 OC(=O)c1nc(Br)ccn1 1P002RR1 [1,1,0,0,0,0|2,0,0]=4 3552 B10R1.113 OC(=O)c1nc(Cl)ccn1 1P003LKW [1,1,0,0,0,0|2,0,0]=4 3553 B10R1.113 OC(=O)c1ncnc(c1)N 1P01FSNP [1,1,0,0,0,0|2,0,0]=4 3554 B10R1.113 Oc1cccc(c1)B(O)O 1P00346Q [1,1,0,0,0,0|1,0,1]=4 3555 B10R1.113 Oc1cccc(c1)C(=N)N 1P00EEVR [1,1,0,0,0,0|2,0,0]=4 3556 B10R1.113 Oc1cccc(c1)C(=O)C 1P003K0U [1,1,0,0,0,0|1,0,0]=3 3557 B10R1.113 Oc1cccc(c1)C(=O)N 1P0037IV [1,1,0,0,0,0|1,0,0]=3 3558 B10R1.113 Oc1cccc(c1)C(=O)O 1P00346R [1,1,0,0,0,0|0,0,0]=2 3559 B10R1.113 Oc1cccc(c1)C(=O)[O-] 1P003URS [1,1,0,0,0,0|0,0,1]=3 3560 B10R1.113 Oc1cccc(c1)C(=S)N 1P007YNT [1,1,0,0,0,0|1,1,0]=4 3561 B10R1.113 Oc1cccc(c1)C(O)C 1P003DDU [1,1,0,0,0,0|1,0,1]=4 3562 B10R1.113 Oc1cccc(c1)S(=O)C 1P001NIU [1,1,0,0,0,0|2,0,0]=4 3563 B10R1.113 Oc1cccc(c1)[C@H](O)C 1P00EL2Y [1,1,0,0,0,0|1,0,1]=4 3564 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] 1P00DEND [1,1,0,0,0,0|1,0,1]=4 3565 B10R1.113 Oc1cccc(n1)C(=O)N 1P01DD88 [1,1,0,0,0,0|2,0,0]=4 3566 B10R1.113 Oc1ccnc(c1)C(=O)O 1P0034J9 [1,1,0,0,0,0|1,0,0]=3 3567 B10R1.113 Oc1cncc(c1)C(=O)O 1P002VC0 [1,1,0,0,0,0|1,0,0]=3 3568 B10R1.113 Oc1cnnc(c1)C(=O)O 1P021ZE5 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.113 Oc1nccc(c1)C(=O)O 1P0033TH [1,1,0,0,0,0|1,0,0]=3 3570 B10R1.113 Sc1cccc(c1)B(O)O 1P00C0T1 [1,1,0,0,0,0|1,0,1]=4 3571 B10R1.113 Sc1cccc(c1)C(=O)C 1P01AK0X [1,1,0,0,0,0|1,0,0]=3 3572 B10R1.113 Sc1cccc(c1)C(=O)N 1P00EIKO [1,1,0,0,0,0|1,0,0]=3 3573 B10R1.113 Sc1cccc(c1)C(=O)O 1P003K32 [1,1,0,0,0,0|0,0,0]=2 3574 B10R1.113 Sc1cccc(c1)[N+](=O)[O-] 1P00CIK9 [1,1,0,0,0,0|1,0,1]=4 3575 B10R1.113 [O-][n+]1cccc(c1)C(=O)C 1P001HRT [1,1,0,0,0,0|2,0,0]=4 3576 B10R1.113 [O-][n+]1cccc(c1)C(=O)N 1P002C45 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.2 C#Cc1cccc(c1O)O 1P00764X [1,1,0,0,0,0|1,0,1]=4 3578 B10R1.2 C=Cc1cccc(c1Br)F 1P01DTVU [1,1,0,0,0,0|2,0,0]=4 3579 B10R1.2 C=Cc1cccc(c1C)Br 1P027YHB [1,1,0,0,0,0|2,0,0]=4 3580 B10R1.2 CCc1cccc(c1O)C 1P001YOW [1,1,0,0,0,0|1,0,1]=4 3581 B10R1.2 CCc1cccc(c1O)N 1P01EMVG [1,1,0,0,0,0|1,0,1]=4 3582 B10R1.2 COc1cccc(c1O)Br 1P00BFVM [1,1,0,0,0,0|2,0,0]=4 3583 B10R1.2 COc1cccc(c1O)C 1P002VGU [1,1,0,0,0,0|2,0,0]=4 3584 B10R1.2 COc1cccc(c1O)Cl 1P005I2H [1,1,0,0,0,0|2,0,0]=4 3585 B10R1.2 COc1cccc(c1O)F 1P005VZE [1,1,0,0,0,0|2,0,0]=4 3586 B10R1.2 COc1cccc(c1O)I 1P007SRF [1,1,0,0,0,0|2,0,0]=4 3587 B10R1.2 COc1cccc(c1O)N 1P0074EL [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.2 COc1cccc(c1O)N 1P00I767 [1,1,0,0,0,0|2,0,0]=4 3589 B10R1.2 N#Cc1cccc(c1O)Br 1P000VD2 [1,1,0,0,0,0|1,0,1]=4 3590 B10R1.2 N#Cc1cccc(c1O)C 1P0072QX [1,1,0,0,0,0|1,0,1]=4 3591 B10R1.2 N#Cc1cccc(c1O)Cl 1P000VD3 [1,1,0,0,0,0|1,0,1]=4 3592 B10R1.2 N#Cc1cccc(c1O)F 1P003A47 [1,1,0,0,0,0|1,0,1]=4 3593 B10R1.2 N#Cc1cccc(c1O)N 1P00FBOD [1,1,0,0,0,0|1,0,1]=4 3594 B10R1.2 N#Cc1cccc(c1O)O 1P003FZX [1,1,0,0,0,0|1,0,1]=4 3595 B10R1.2 NCc1cccc(c1O)Br 1P01BER5 [1,1,0,0,0,0|1,0,1]=4 3596 B10R1.2 NCc1cccc(c1O)C 1P00I3WJ [1,1,0,0,0,0|1,0,1]=4 3597 B10R1.2 NCc1cccc(c1O)Cl 1P01EMWJ [1,1,0,0,0,0|1,0,1]=4 3598 B10R1.2 NCc1cccc(c1O)F 1P004EBZ [1,1,0,0,0,0|1,0,1]=4 3599 B10R1.2 NCc1cccc(c1O)O 1P01BU7I [1,1,0,0,0,0|1,0,1]=4 3600 B10R1.2 O=Cc1cccc(=O)n1C 1P01EE68 [1,1,0,0,0,0|2,0,0]=4 3601 B10R1.2 O=Cc1cccc(c1Br)Br 1P0037TL [1,1,0,0,0,0|1,0,0]=3 3602 B10R1.2 O=Cc1cccc(c1Br)C 1P0097G9 [1,1,0,0,0,0|1,0,0]=3 3603 B10R1.2 O=Cc1cccc(c1Br)Cl 1P0036Z6 [1,1,0,0,0,0|1,0,0]=3 3604 B10R1.2 O=Cc1cccc(c1Br)F 1P0038TS [1,1,0,0,0,0|1,0,0]=3 3605 B10R1.2 O=Cc1cccc(c1Br)I 1P01FHFZ [1,1,0,0,0,0|1,0,0]=3 3606 B10R1.2 O=Cc1cccc(c1Br)O 1P0038CG [1,1,0,0,0,0|1,0,0]=3 3607 B10R1.2 O=Cc1cccc(c1C)Br 1P004YKO [1,1,0,0,0,0|1,0,0]=3 3608 B10R1.2 O=Cc1cccc(c1C)C 1P0033EV [1,1,0,0,0,0|1,0,0]=3 3609 B10R1.2 O=Cc1cccc(c1C)Cl 1P004GNE [1,1,0,0,0,0|1,0,0]=3 3610 B10R1.2 O=Cc1cccc(c1C)F 1P001FIH [1,1,0,0,0,0|1,0,0]=3 3611 B10R1.2 O=Cc1cccc(c1C)I 1P00OSDY [1,1,0,0,0,0|1,0,0]=3 3612 B10R1.2 O=Cc1cccc(c1C)O 1P00H1EC [1,1,0,0,0,0|1,0,0]=3 3613 B10R1.2 O=Cc1cccc(c1Cl)Br 1P000PXW [1,1,0,0,0,0|1,0,0]=3 3614 B10R1.2 O=Cc1cccc(c1Cl)C 1P00EELU [1,1,0,0,0,0|1,0,0]=3 3615 B10R1.2 O=Cc1cccc(c1Cl)Cl 1P003FY3 [1,1,0,0,0,0|1,0,0]=3 3616 B10R1.2 O=Cc1cccc(c1Cl)F 1P0033O4 [1,1,0,0,0,0|1,0,0]=3 3617 B10R1.2 O=Cc1cccc(c1Cl)O 1P003HCB [1,1,0,0,0,0|1,0,0]=3 3618 B10R1.2 O=Cc1cccc(c1F)Br 1P001MLU [1,1,0,0,0,0|1,0,0]=3 3619 B10R1.2 O=Cc1cccc(c1F)C 1P008AB4 [1,1,0,0,0,0|1,0,0]=3 3620 B10R1.2 O=Cc1cccc(c1F)Cl 1P003444 [1,1,0,0,0,0|1,0,0]=3 3621 B10R1.2 O=Cc1cccc(c1F)F 1P002TSG [1,1,0,0,0,0|1,0,0]=3 3622 B10R1.2 O=Cc1cccc(c1F)I 1P001E6M [1,1,0,0,0,0|1,0,0]=3 3623 B10R1.2 O=Cc1cccc(c1F)O 1P008T4O [1,1,0,0,0,0|1,0,0]=3 3624 B10R1.2 O=Cc1cccc(c1I)Br 1P01FQWF [1,1,0,0,0,0|1,0,0]=3 3625 B10R1.2 O=Cc1cccc(c1I)F 1P00GV5B [1,1,0,0,0,0|1,0,0]=3 3626 B10R1.2 O=Cc1cccc(c1N)Br 1P001L2F [1,1,0,0,0,0|1,0,0]=3 3627 B10R1.2 O=Cc1cccc(c1N)C 1P00IDXT [1,1,0,0,0,0|1,0,0]=3 3628 B10R1.2 O=Cc1cccc(c1N)Cl 1P00CLCU [1,1,0,0,0,0|1,0,0]=3 3629 B10R1.2 O=Cc1cccc(c1N)F 1P00G7IC [1,1,0,0,0,0|1,0,0]=3 3630 B10R1.2 O=Cc1cccc(c1N)I 1P000SI8 [1,1,0,0,0,0|1,0,0]=3 3631 B10R1.2 O=Cc1cccc(c1N)O 1P0002I2 [1,1,0,0,0,0|1,0,0]=3 3632 B10R1.2 O=Cc1cccc(c1O)Br 1P0024OU [1,1,0,0,0,0|0,0,0]=2 3633 B10R1.2 O=Cc1cccc(c1O)C 1P003HUO [1,1,0,0,0,0|0,0,0]=2 3634 B10R1.2 O=Cc1cccc(c1O)Cl 1P003JNO [1,1,0,0,0,0|0,0,0]=2 3635 B10R1.2 O=Cc1cccc(c1O)F 1P00345Q [1,1,0,0,0,0|0,0,0]=2 3636 B10R1.2 O=Cc1cccc(c1O)I 1P002OCE [1,1,0,0,0,0|0,0,0]=2 3637 B10R1.2 O=Cc1cccc(c1O)O 1P002PH0 [1,1,0,0,0,0|0,0,0]=2 3638 B10R1.2 O=Cc1cccn(c1=O)C 1P003BDJ [1,1,0,0,0,0|1,0,1]=4 3639 B10R1.2 O=Cc1ccnc(c1Br)Cl 1P01DO3O [1,1,0,0,0,0|2,0,0]=4 3640 B10R1.2 O=Cc1ccnc(c1C)Cl 1P005C7S [1,1,0,0,0,0|2,0,0]=4 3641 B10R1.2 O=Cc1ccnc(c1C)F 1P01BHSX [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.2 O=Cc1ccnc(c1C)N 1P01B7CL [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.2 O=Cc1ccnc(c1Cl)Cl 1P0036S3 [1,1,0,0,0,0|2,0,0]=4 3644 B10R1.2 O=Cc1ccnc(c1Cl)F 1P000FXJ [1,1,0,0,0,0|2,0,0]=4 3645 B10R1.2 O=Cc1ccnc(c1F)Br 1P000JRU [1,1,0,0,0,0|2,0,0]=4 3646 B10R1.2 O=Cc1ccnc(c1F)Cl 1P007IHX [1,1,0,0,0,0|2,0,0]=4 3647 B10R1.2 O=Cc1ccnc(c1F)F 1P009H0D [1,1,0,0,0,0|2,0,0]=4 3648 B10R1.2 O=Cc1ccnc(c1N)Br 1P01AGOX [1,1,0,0,0,0|2,0,0]=4 3649 B10R1.2 O=Cc1ccnc(c1N)Cl 1P000YYJ [1,1,0,0,0,0|2,0,0]=4 3650 B10R1.2 O=Cc1ccnc(c1O)Cl 1P0095Q5 [1,1,0,0,0,0|1,0,0]=3 3651 B10R1.2 O=Cc1ccnc(c1O)F 1P024DSS [1,1,0,0,0,0|1,0,0]=3 3652 B10R1.2 O=Cc1cncc(c1C)Br 1P00CJ8M [1,1,0,0,0,0|2,0,0]=4 3653 B10R1.2 O=Cc1cncc(c1Cl)Br 1P00HB7O [1,1,0,0,0,0|2,0,0]=4 3654 B10R1.2 O=Cc1cncc(c1Cl)Cl 1P0003PL [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.2 O=Cc1cncc(c1Cl)F 1P008ZKC [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.2 O=Cc1cncc(c1N)Br 1P000YXS [1,1,0,0,0,0|2,0,0]=4 3657 B10R1.2 O=Cc1cncc(c1N)Cl 1P000YZT [1,1,0,0,0,0|2,0,0]=4 3658 B10R1.2 O=Cc1cncc(c1O)Br 1P000YZ8 [1,1,0,0,0,0|1,0,0]=3 3659 B10R1.2 O=Cc1nccc(c1Br)Br 1P0288H7 [1,1,0,0,0,0|2,0,0]=4 3660 B10R1.2 O=Cc1nccc(c1Br)C 1P009JRY [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.2 O=Cc1nccc(c1Br)Cl 1P009XVD [1,1,0,0,0,0|2,0,0]=4 3662 B10R1.2 O=Cc1nccc(c1C)Cl 1P01JJT1 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.2 O=Cc1nccc(c1Cl)Cl 1P024US4 [1,1,0,0,0,0|2,0,0]=4 3664 B10R1.2 O=Cc1nccc(c1F)Br 1P01KKIS [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.2 O=Cc1nccc(c1F)Cl 1P000RZC [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.2 O=Cc1nccc(c1F)F 1P01SP03 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.2 O=Cc1nccc(c1N)C 1P028AMA [1,1,0,0,0,0|2,0,0]=4 3668 B10R1.2 O=Cc1nccc(c1O)Cl 1P027TU6 [1,1,0,0,0,0|1,0,0]=3 3669 B10R1.2 OCc1cccc(c1Br)Br 1P00158W [1,1,0,0,0,0|1,0,1]=4 3670 B10R1.2 OCc1cccc(c1Br)C 1P00AR4Y [1,1,0,0,0,0|1,0,1]=4 3671 B10R1.2 OCc1cccc(c1Br)Cl 1P000KOR [1,1,0,0,0,0|1,0,1]=4 3672 B10R1.2 OCc1cccc(c1Br)F 1P008Y6N [1,1,0,0,0,0|1,0,1]=4 3673 B10R1.2 OCc1cccc(c1Br)I 1P000SDD [1,1,0,0,0,0|1,0,1]=4 3674 B10R1.2 OCc1cccc(c1C)Br 1P0038VI [1,1,0,0,0,0|1,0,1]=4 3675 B10R1.2 OCc1cccc(c1C)C 1P0012ED [1,1,0,0,0,0|1,0,1]=4 3676 B10R1.2 OCc1cccc(c1C)Cl 1P00IGKZ [1,1,0,0,0,0|1,0,1]=4 3677 B10R1.2 OCc1cccc(c1C)F 1P00DC7P [1,1,0,0,0,0|1,0,1]=4 3678 B10R1.2 OCc1cccc(c1C)I 1P008OBT [1,1,0,0,0,0|1,0,1]=4 3679 B10R1.2 OCc1cccc(c1C)N 1P003JB7 [1,1,0,0,0,0|1,0,1]=4 3680 B10R1.2 OCc1cccc(c1C)N 1P005QTQ [1,1,0,0,0,0|1,0,1]=4 3681 B10R1.2 OCc1cccc(c1C)O 1P00DL9Y [1,1,0,0,0,0|1,0,1]=4 3682 B10R1.2 OCc1cccc(c1Cl)Br 1P000S9U [1,1,0,0,0,0|1,0,1]=4 3683 B10R1.2 OCc1cccc(c1Cl)C 1P00EMD1 [1,1,0,0,0,0|1,0,1]=4 3684 B10R1.2 OCc1cccc(c1Cl)Cl 1P003FY6 [1,1,0,0,0,0|1,0,1]=4 3685 B10R1.2 OCc1cccc(c1Cl)F 1P005UCC [1,1,0,0,0,0|1,0,1]=4 3686 B10R1.2 OCc1cccc(c1Cl)N 1P0012SP [1,1,0,0,0,0|1,0,1]=4 3687 B10R1.2 OCc1cccc(c1Cl)O 1P002V31 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.2 OCc1cccc(c1F)Br 1P002SG5 [1,1,0,0,0,0|1,0,1]=4 3689 B10R1.2 OCc1cccc(c1F)C 1P0031RR [1,1,0,0,0,0|1,0,1]=4 3690 B10R1.2 OCc1cccc(c1F)Cl 1P002SG6 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.2 OCc1cccc(c1F)F 1P003FZ9 [1,1,0,0,0,0|1,0,1]=4 3692 B10R1.2 OCc1cccc(c1F)I 1P01K74Z [1,1,0,0,0,0|1,0,1]=4 3693 B10R1.2 OCc1cccc(c1F)N 1P007XIQ [1,1,0,0,0,0|1,0,1]=4 3694 B10R1.2 OCc1cccc(c1I)Br 1P000SBM [1,1,0,0,0,0|1,0,1]=4 3695 B10R1.2 OCc1cccc(c1I)C 1P009444 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.2 OCc1cccc(c1I)F 1P000SIO [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.2 OCc1cccc(c1N)Br 1P00CMFE [1,1,0,0,0,0|1,0,1]=4 3698 B10R1.2 OCc1cccc(c1N)C 1P003GUF [1,1,0,0,0,0|1,0,1]=4 3699 B10R1.2 OCc1cccc(c1N)Cl 1P00392B [1,1,0,0,0,0|1,0,1]=4 3700 B10R1.2 OCc1cccc(c1N)F 1P00IGQ7 [1,1,0,0,0,0|1,0,1]=4 3701 B10R1.2 OCc1cccc(c1N)O 1P00ANLO [1,1,0,0,0,0|1,0,1]=4 3702 B10R1.2 OCc1cccc(c1O)C 1P00BJKZ [1,1,0,0,0,0|0,0,1]=3 3703 B10R1.2 OCc1cccc(c1O)O 1P009HH8 [1,1,0,0,0,0|0,0,1]=3 3704 B10R1.2 OCc1occc(=O)c1O 1P00B3T2 [1,1,0,0,0,0|1,0,1]=4 3705 B10R1.2 ONc1cccc(c1Cl)Cl 1P01FQHI [1,1,0,0,0,0|2,0,0]=4 3706 B10R1.4 BrCCc1ccccc1O 1P00ELH4 [1,1,0,0,0,0|1,0,1]=4 3707 B10R1.4 Br\C=C/c1ccccc1F 1P028BPP [1,1,0,0,0,0|2,0,0]=4 3708 B10R1.4 C#CCc1ccccc1O 1P00CLW6 [1,1,0,0,0,0|1,0,1]=4 3709 B10R1.4 C=CCc1ccccc1Br 1P003EDU [1,1,0,0,0,0|2,0,0]=4 3710 B10R1.4 C=CCc1ccccc1C 1P001R8K [1,1,0,0,0,0|2,0,0]=4 3711 B10R1.4 C=CCc1ccccc1Cl 1P001R8I [1,1,0,0,0,0|2,0,0]=4 3712 B10R1.4 C=CCc1ccccc1O 1P002064 [1,1,0,0,0,0|1,0,0]=3 3713 B10R1.4 CCNc1ccccc1O 1P0037GB [1,1,0,0,0,0|1,0,1]=4 3714 B10R1.4 CCNc1ccccc1O 1P0282E1 [1,1,0,0,0,0|1,0,1]=4 3715 B10R1.4 CCSc1ccccc1O 1P002Z6A [1,1,0,0,0,0|1,0,1]=4 3716 B10R1.4 CNCc1ccccc1O 1P003HWH [1,1,0,0,0,0|1,0,1]=4 3717 B10R1.4 CNCc1ccccc1O 1P00IBRS [1,1,0,0,0,0|1,0,1]=4 3718 B10R1.4 CNCc1ccccc1O 1P019NN0 [1,1,0,0,0,0|1,0,1]=4 3719 B10R1.4 COCc1ccccc1Br 1P00DAT5 [1,1,0,0,0,0|1,0,1]=4 3720 B10R1.4 COCc1ccccc1N 1P019UQK [1,1,0,0,0,0|1,0,1]=4 3721 B10R1.4 COCc1ccccc1O 1P00EIVC [1,1,0,0,0,0|0,0,1]=3 3722 B10R1.4 Cc1ncccc1\C=N/O 1P024ZS2 [1,1,0,0,0,0|2,0,0]=4 3723 B10R1.4 N#CCc1ccccc1O 1P001F4B [1,1,0,0,0,0|1,0,1]=4 3724 B10R1.4 NCCc1ccccc1O 1P0029N4 [1,1,0,0,0,0|1,0,1]=4 3725 B10R1.4 NCCc1ccccc1O 1P019VVD [1,1,0,0,0,0|1,0,1]=4 3726 B10R1.4 NN=Cc1ccccc1O 1P00BLJ2 [1,1,0,0,0,0|1,0,0]=3 3727 B10R1.4 NNCc1ccccc1O 1P028ZMU [1,1,0,0,0,0|1,0,1]=4 3728 B10R1.4 NOCc1ccccc1C 1P008PH3 [1,1,0,0,0,0|1,0,1]=4 3729 B10R1.4 NOCc1ccccc1Cl 1P00DJ0J [1,1,0,0,0,0|1,0,1]=4 3730 B10R1.4 NOCc1ccccc1F 1P00BHGU [1,1,0,0,0,0|1,0,1]=4 3731 B10R1.4 Nc1ncccc1C=NO 1P0220O8 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.4 Nc1ncccc1\C=N\O 1P003H0M [1,1,0,0,0,0|2,0,0]=4 3733 B10R1.4 O=C=Nc1ccccc1Br 1P003BNC [1,1,0,0,0,0|1,0,1]=4 3734 B10R1.4 O=C=Nc1ccccc1C 1P003TYY [1,1,0,0,0,0|1,0,1]=4 3735 B10R1.4 O=C=Nc1ccccc1F 1P001XUW [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.4 O=C=Nc1ccccc1I 1P000YE4 [1,1,0,0,0,0|1,0,1]=4 3737 B10R1.4 O=CCc1ccccc1Br 1P00IKAJ [1,1,0,0,0,0|1,0,0]=3 3738 B10R1.4 O=CCc1ccccc1Cl 1P00BZYQ [1,1,0,0,0,0|1,0,0]=3 3739 B10R1.4 O=CCc1ccccc1F 1P008QZL [1,1,0,0,0,0|1,0,0]=3 3740 B10R1.4 O=CNc1ccccc1Br 1P00049S [1,1,0,0,0,0|1,0,0]=3 3741 B10R1.4 O=CNc1ccccc1C 1P00GWAW [1,1,0,0,0,0|1,0,0]=3 3742 B10R1.4 O=CNc1ccccc1O 1P00BDFK [1,1,0,0,0,0|0,0,0]=2 3743 B10R1.4 O=NC=c1ccccn1C 1P00HW8E [1,1,0,0,0,0|2,0,0]=4 3744 B10R1.4 OCCc1ccccc1Br 1P0033B7 [1,1,0,0,0,0|1,0,1]=4 3745 B10R1.4 OCCc1ccccc1C 1P002BSO [1,1,0,0,0,0|1,0,1]=4 3746 B10R1.4 OCCc1ccccc1Cl 1P002BSP [1,1,0,0,0,0|1,0,1]=4 3747 B10R1.4 OCCc1ccccc1F 1P003HSQ [1,1,0,0,0,0|1,0,1]=4 3748 B10R1.4 OCCc1ccccc1I 1P002S0H [1,1,0,0,0,0|1,0,1]=4 3749 B10R1.4 OCCc1ccccc1N 1P0033L2 [1,1,0,0,0,0|1,0,1]=4 3750 B10R1.4 OCCc1ccccc1N 1P028P0Y [1,1,0,0,0,0|1,0,1]=4 3751 B10R1.4 ON=Cc1ccccc1Br 1P019IQ9 [1,1,0,0,0,0|1,0,0]=3 3752 B10R1.4 ON=Cc1ccccc1C 1P001EU6 [1,1,0,0,0,0|1,0,0]=3 3753 B10R1.4 ON=Cc1ccccc1O 1P002L2T [1,1,0,0,0,0|0,0,0]=2 3754 B10R1.4 ONCc1ccccc1Cl 1P01BIC9 [1,1,0,0,0,0|1,0,1]=4 3755 B10R1.4 O\N=C\c1cccc[n+]1C 1P003IDP [1,1,0,0,0,0|2,0,0]=4 3756 B10R1.4 O\N=C\c1cccc[n+]1C 1P003IDQ [1,1,0,0,0,0|2,0,0]=4 3757 B10R1.4 O\N=C\c1ccccc1Br 1P003H85 [1,1,0,0,0,0|1,0,0]=3 3758 B10R1.4 O\N=C\c1ccccc1Cl 1P003HI6 [1,1,0,0,0,0|1,0,0]=3 3759 B10R1.4 O\N=C\c1ccccc1F 1P002PFF [1,1,0,0,0,0|1,0,0]=3 3760 B10R1.4 O\N=C\c1ccccc1O 1P003UN9 [1,1,0,0,0,0|0,0,0]=2 3761 B10R1.4 [NH3+]OCc1ccccc1Br 1P006VPJ [1,1,0,0,0,0|1,0,1]=4 3762 B10R1.20 BrCc1ccccc1CO 1P003FGP [1,1,0,0,0,0|1,0,1]=4 3763 B10R1.20 C#Cc1ccccc1C=O 1P003HOY [1,1,0,0,0,0|1,0,0]=3 3764 B10R1.20 C#Cc1ccccc1CO 1P00852T [1,1,0,0,0,0|1,0,1]=4 3765 B10R1.20 C#Cc1ccccc1OC 1P00G2PH [1,1,0,0,0,0|1,0,1]=4 3766 B10R1.20 C=Cc1ccccc1C=C 1P0010O1 [1,1,0,0,0,0|2,0,0]=4 3767 B10R1.20 C=Cc1ccccc1CO 1P00I7F4 [1,1,0,0,0,0|1,0,0]=3 3768 B10R1.20 C=Cc1ccccc1OC 1P003IFD [1,1,0,0,0,0|1,0,0]=3 3769 B10R1.20 CCc1ccccc1C=C 1P006EB5 [1,1,0,0,0,0|2,0,0]=4 3770 B10R1.20 CCc1cccnc1C=O 1P028QR1 [1,1,0,0,0,0|2,0,0]=4 3771 B10R1.20 CCc1cnccc1C=O 1P02840G [1,1,0,0,0,0|2,0,0]=4 3772 B10R1.20 CCc1ncccc1C=O 1P00KEMW [1,1,0,0,0,0|2,0,0]=4 3773 B10R1.20 CNc1ccccc1CO 1P002XNH [1,1,0,0,0,0|1,0,1]=4 3774 B10R1.20 CNc1ncccc1C=O 1P00383H [1,1,0,0,0,0|2,0,0]=4 3775 B10R1.20 CNc1ncccc1C=O 1P00J1KK [1,1,0,0,0,0|2,0,0]=4 3776 B10R1.20 COc1ccccc1CC 1P001FV1 [1,1,0,0,0,0|1,0,1]=4 3777 B10R1.20 COc1ccccc1CCl 1P00FAJI [1,1,0,0,0,0|1,0,1]=4 3778 B10R1.20 COc1ccccc1CN 1P0033U9 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.20 COc1ccccc1CO 1P0033U8 [1,1,0,0,0,0|0,0,1]=3 3780 B10R1.20 COc1ccccc1CS 1P00H232 [1,1,0,0,0,0|0,1,1]=4 3781 B10R1.20 COc1ccccc1NC 1P003BPL [1,1,0,0,0,0|2,0,0]=4 3782 B10R1.20 COc1ccccc1NC 1P01B5L6 [1,1,0,0,0,0|2,0,0]=4 3783 B10R1.20 COc1ccccc1NN 1P0032SU [1,1,0,0,0,0|2,0,0]=4 3784 B10R1.20 COc1cccnc1C=O 1P00757W [1,1,0,0,0,0|1,0,0]=3 3785 B10R1.20 COc1cccnc1CO 1P00DG0S [1,1,0,0,0,0|1,0,1]=4 3786 B10R1.20 COc1ccncc1C=O 1P0056GA [1,1,0,0,0,0|1,0,0]=3 3787 B10R1.20 COc1ccncc1CO 1P0096YQ [1,1,0,0,0,0|1,0,1]=4 3788 B10R1.20 COc1cnccc1C=O 1P00AP8F [1,1,0,0,0,0|1,0,0]=3 3789 B10R1.20 COc1cnccc1CO 1P00071R [1,1,0,0,0,0|1,0,1]=4 3790 B10R1.20 COc1cncnc1C=O 1P0284VY [1,1,0,0,0,0|2,0,0]=4 3791 B10R1.20 COc1ncccc1C=O 1P006AHW [1,1,0,0,0,0|1,0,0]=3 3792 B10R1.20 COc1ncccc1CO 1P0083MJ [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.20 COc1ncncc1C=O 1P00A8V7 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.20 CSc1ccccc1CO 1P00BYKB [1,1,0,0,0,0|0,1,1]=4 3795 B10R1.20 CSc1ccccc1OC 1P003I1B [1,1,0,0,0,0|2,0,0]=4 3796 B10R1.20 FCc1ccccc1CO 1P00HTNI [1,1,0,0,0,0|1,0,1]=4 3797 B10R1.20 N#Cc1ccccc1C=O 1P003HKV [1,1,0,0,0,0|1,0,0]=3 3798 B10R1.20 N#Cc1ccccc1CO 1P003FJB [1,1,0,0,0,0|1,0,1]=4 3799 B10R1.20 N#Cc1ccccc1OC 1P003I0H [1,1,0,0,0,0|1,0,1]=4 3800 B10R1.20 O=Cc1ccccc1C=O 1P0035Y5 [1,1,0,0,0,0|0,0,1]=3 3801 B10R1.20 O=Cc1ccccc1CC 1P002LZX [1,1,0,0,0,0|1,0,0]=3 3802 B10R1.20 O=Cc1ccccc1CF 1P01C7H1 [1,1,0,0,0,0|1,0,0]=3 3803 B10R1.20 O=Cc1ccccc1NC 1P008PC6 [1,1,0,0,0,0|1,0,0]=3 3804 B10R1.20 O=Cc1ccccc1OC 1P003I0D [1,1,0,0,0,0|0,0,0]=2 3805 B10R1.20 O=Cc1ccccc1SC 1P003FK4 [1,1,0,0,0,0|0,1,0]=3 3806 B10R1.20 O=Cc1cccnc1C#N 1P00104T [1,1,0,0,0,0|2,0,0]=4 3807 B10R1.20 O=Cc1ccncc1C#N 1P01DPZV [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.20 O=Cc1ncccc1C#N 1P00C7F4 [1,1,0,0,0,0|2,0,0]=4 3809 B10R1.20 O=Cc1nccnc1OC 1P00EDQW [1,1,0,0,0,0|2,0,0]=4 3810 B10R1.20 OCc1ccccc1CC 1P003C3Q [1,1,0,0,0,0|1,0,1]=4 3811 B10R1.20 OCc1ccccc1CN 1P003FFN [1,1,0,0,0,0|1,0,1]=4 3812 B10R1.20 OCc1ccccc1CO 1P00IBA6 [1,1,0,0,0,0|0,0,1]=3 3813 B10R1.20 OCc1cnccc1CO 1P00CLWD [1,1,0,0,0,0|1,0,1]=4 3814 B10R1.20 OCc1cnccc1CO 1P00IA13 [1,1,0,0,0,0|1,0,1]=4 3815 B10R1.20 OCc1ncccc1CO 1P00736Q [1,1,0,0,0,0|1,0,1]=4 3816 B10R1.20 OCc1ncccc1CO 1P00CI5W [1,1,0,0,0,0|1,0,1]=4 3817 B10R1.20 [C-]#[N+]c1ccccc1OC 1P002JOM [1,1,0,0,0,0|2,0,0]=4 3818 B10R1.25 Brc1cc(Br)ncc1C=O 1P00A0YQ [1,1,0,0,0,0|2,0,0]=4 3819 B10R1.25 Brc1ccc(c(=O)[nH]1)C=O 1P01KKGC [1,1,0,0,0,0|1,0,1]=4 3820 B10R1.25 Brc1nc(Br)ccc1C=O 1P00DGH0 [1,1,0,0,0,0|2,0,0]=4 3821 B10R1.25 C=Cc1ccc(cc1Br)Cl 1P01A07S [1,1,0,0,0,0|2,0,0]=4 3822 B10R1.25 C=Cc1ccc(cc1Br)F 1P0017C1 [1,1,0,0,0,0|2,0,0]=4 3823 B10R1.25 C=Cc1ccc(cc1C)Br 1P01C7QN [1,1,0,0,0,0|2,0,0]=4 3824 B10R1.25 C=Cc1ccc(cc1C)C 1P003GBE [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.25 C=Cc1ccc(cc1Cl)Br 1P01C7QJ [1,1,0,0,0,0|2,0,0]=4 3826 B10R1.25 C=Cc1ccc(cc1Cl)Cl 1P00BGD6 [1,1,0,0,0,0|2,0,0]=4 3827 B10R1.25 C=Cc1ccc(cc1Cl)I 1P028ZQ9 [1,1,0,0,0,0|2,0,0]=4 3828 B10R1.25 C=Cc1ccc(cc1F)Br 1P00EEEX [1,1,0,0,0,0|2,0,0]=4 3829 B10R1.25 C=Cc1ccc(cc1F)F 1P0076VV [1,1,0,0,0,0|2,0,0]=4 3830 B10R1.25 C=Cc1ccc(cc1O)F 1P027UZZ [1,1,0,0,0,0|1,0,0]=3 3831 B10R1.25 CCc1ccc(cc1O)Br 1P0280XI [1,1,0,0,0,0|1,0,1]=4 3832 B10R1.25 CCc1ccc(cc1O)C 1P001YOX [1,1,0,0,0,0|1,0,1]=4 3833 B10R1.25 CCc1ccc(cc1O)N 1P028YL3 [1,1,0,0,0,0|1,0,1]=4 3834 B10R1.25 CCc1ccc(cc1O)O 1P002VGX [1,1,0,0,0,0|1,0,1]=4 3835 B10R1.25 COc1ccc(cc1O)Br 1P0036PD [1,1,0,0,0,0|2,0,0]=4 3836 B10R1.25 COc1ccc(cc1O)Br 1P00H9DI [1,1,0,0,0,0|2,0,0]=4 3837 B10R1.25 COc1ccc(cc1O)C 1P000POI [1,1,0,0,0,0|2,0,0]=4 3838 B10R1.25 COc1ccc(cc1O)Cl 1P00BZZ1 [1,1,0,0,0,0|2,0,0]=4 3839 B10R1.25 COc1ccc(cc1O)F 1P003N7L [1,1,0,0,0,0|2,0,0]=4 3840 B10R1.25 COc1ccc(cc1O)I 1P001S9P [1,1,0,0,0,0|2,0,0]=4 3841 B10R1.25 COc1ccc(cc1O)N 1P001YOZ [1,1,0,0,0,0|2,0,0]=4 3842 B10R1.25 COc1ccc(cc1O)O 1P00EASO [1,1,0,0,0,0|2,0,0]=4 3843 B10R1.25 Cc1cc(Br)ncc1C=O 1P006G7O [1,1,0,0,0,0|2,0,0]=4 3844 B10R1.25 Cc1cc(C)ncc1C=O 1P000DOU [1,1,0,0,0,0|2,0,0]=4 3845 B10R1.25 Cc1cc(Cl)ncc1C=O 1P00GSNC [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.25 Cc1cc(F)ncc1C=O 1P009G4G [1,1,0,0,0,0|2,0,0]=4 3847 B10R1.25 Cc1cc(O)ncc1C=O 1P01EMLG [1,1,0,0,0,0|2,0,0]=4 3848 B10R1.25 Cc1ccc(c(n1)Br)C=O 1P004M5B [1,1,0,0,0,0|2,0,0]=4 3849 B10R1.25 Cc1ccc(c(n1)Cl)C=O 1P003A5J [1,1,0,0,0,0|2,0,0]=4 3850 B10R1.25 Cc1ccc(c(n1)N)C=O 1P0089RW [1,1,0,0,0,0|2,0,0]=4 3851 B10R1.25 Cc1nc(Br)ccc1C=O 1P006G7P [1,1,0,0,0,0|2,0,0]=4 3852 B10R1.25 Cc1nc(C)ccc1C=O 1P00EAFE [1,1,0,0,0,0|2,0,0]=4 3853 B10R1.25 Cc1nc(Cl)ccc1C=O 1P004F2R [1,1,0,0,0,0|2,0,0]=4 3854 B10R1.25 Cc1nc(F)ccc1C=O 1P004K07 [1,1,0,0,0,0|2,0,0]=4 3855 B10R1.25 Clc1cc(Br)c(cn1)C=O 1P008YVE [1,1,0,0,0,0|2,0,0]=4 3856 B10R1.25 Clc1cc(Br)ncc1C=O 1P008YVI [1,1,0,0,0,0|2,0,0]=4 3857 B10R1.25 Clc1cc(Cl)ncc1C=O 1P0034C5 [1,1,0,0,0,0|2,0,0]=4 3858 B10R1.25 Clc1ccc(c(n1)Br)C=O 1P0084VC [1,1,0,0,0,0|2,0,0]=4 3859 B10R1.25 Clc1nc(Br)ccc1C=O 1P008VE9 [1,1,0,0,0,0|2,0,0]=4 3860 B10R1.25 Clc1nc(Cl)ccc1C=O 1P0033I3 [1,1,0,0,0,0|2,0,0]=4 3861 B10R1.25 Fc1cc(Cl)c(cn1)C=O 1P000OWF [1,1,0,0,0,0|2,0,0]=4 3862 B10R1.25 Fc1cc(Cl)ncc1C=O 1P00HB81 [1,1,0,0,0,0|2,0,0]=4 3863 B10R1.25 Fc1ccc(c(n1)Br)C=O 1P01BUNV [1,1,0,0,0,0|2,0,0]=4 3864 B10R1.25 Fc1ccc(c(n1)Cl)C=O 1P000JR7 [1,1,0,0,0,0|2,0,0]=4 3865 B10R1.25 Fc1nc(Br)ccc1C=O 1P000JU6 [1,1,0,0,0,0|2,0,0]=4 3866 B10R1.25 Fc1nc(Cl)ccc1C=O 1P003ASE [1,1,0,0,0,0|2,0,0]=4 3867 B10R1.25 Fc1nc(F)ccc1C=O 1P001OIW [1,1,0,0,0,0|2,0,0]=4 3868 B10R1.25 N#Cc1ccc(cc1O)Br 1P002X10 [1,1,0,0,0,0|1,0,1]=4 3869 B10R1.25 N#Cc1ccc(cc1O)C 1P007SB3 [1,1,0,0,0,0|1,0,1]=4 3870 B10R1.25 N#Cc1ccc(cc1O)Cl 1P0031UJ [1,1,0,0,0,0|1,0,1]=4 3871 B10R1.25 N#Cc1ccc(cc1O)F 1P00AMGZ [1,1,0,0,0,0|1,0,1]=4 3872 B10R1.25 N#Cc1ccc(cc1O)N 1P0038Y5 [1,1,0,0,0,0|1,0,1]=4 3873 B10R1.25 N#Cc1ccc(cc1O)O 1P00EBQZ [1,1,0,0,0,0|1,0,1]=4 3874 B10R1.25 NCc1ccc(cc1O)Br 1P0092VW [1,1,0,0,0,0|1,0,1]=4 3875 B10R1.25 NCc1ccc(cc1O)C 1P028P9H [1,1,0,0,0,0|1,0,1]=4 3876 B10R1.25 NCc1ccc(cc1O)Cl 1P028XH6 [1,1,0,0,0,0|1,0,1]=4 3877 B10R1.25 NCc1ccc(cc1O)F 1P00IESV [1,1,0,0,0,0|1,0,1]=4 3878 B10R1.25 NCc1ccc(cc1O)F 1P01BG72 [1,1,0,0,0,0|1,0,1]=4 3879 B10R1.25 NCc1ccc(cc1O)F 1P01BGH1 [1,1,0,0,0,0|1,0,1]=4 3880 B10R1.25 NCc1ccc(cc1O)N 1P01FIBD [1,1,0,0,0,0|1,0,1]=4 3881 B10R1.25 NCc1ccc(cc1O)O 1P00J27N [1,1,0,0,0,0|1,0,1]=4 3882 B10R1.25 Nc1cc(Cl)ncc1C=O 1P0001LT [1,1,0,0,0,0|2,0,0]=4 3883 B10R1.25 Nc1ccc(c(n1)Br)C=O 1P00KERG [1,1,0,0,0,0|2,0,0]=4 3884 B10R1.25 Nc1nc(Br)ccc1C=O 1P000PT8 [1,1,0,0,0,0|2,0,0]=4 3885 B10R1.25 Nc1nc(Cl)ccc1C=O 1P00EA8N [1,1,0,0,0,0|2,0,0]=4 3886 B10R1.25 Nc1nc(Cl)ccc1C=O 1P027VH5 [1,1,0,0,0,0|2,0,0]=4 3887 B10R1.25 O=Cc1ccc(=O)[nH]c1C 1P0207HL [1,1,0,0,0,0|2,0,0]=4 3888 B10R1.25 O=Cc1ccc(cc1Br)Br 1P00EGIA [1,1,0,0,0,0|1,0,0]=3 3889 B10R1.25 O=Cc1ccc(cc1Br)C 1P008K1F [1,1,0,0,0,0|1,0,0]=3 3890 B10R1.25 O=Cc1ccc(cc1Br)Cl 1P0055HL [1,1,0,0,0,0|1,0,0]=3 3891 B10R1.25 O=Cc1ccc(cc1Br)F 1P0036MA [1,1,0,0,0,0|1,0,0]=3 3892 B10R1.25 O=Cc1ccc(cc1Br)I 1P002SLM [1,1,0,0,0,0|1,0,0]=3 3893 B10R1.25 O=Cc1ccc(cc1Br)N 1P00ELGH [1,1,0,0,0,0|1,0,0]=3 3894 B10R1.25 O=Cc1ccc(cc1Br)O 1P007OSX [1,1,0,0,0,0|1,0,0]=3 3895 B10R1.25 O=Cc1ccc(cc1C)Br 1P0034EA [1,1,0,0,0,0|1,0,0]=3 3896 B10R1.25 O=Cc1ccc(cc1C)C 1P001Q22 [1,1,0,0,0,0|1,0,0]=3 3897 B10R1.25 O=Cc1ccc(cc1C)Cl 1P00BZSI [1,1,0,0,0,0|1,0,0]=3 3898 B10R1.25 O=Cc1ccc(cc1C)F 1P003LTX [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.25 O=Cc1ccc(cc1C)O 1P0037OK [1,1,0,0,0,0|1,0,0]=3 3900 B10R1.25 O=Cc1ccc(cc1Cl)Br 1P001QNL [1,1,0,0,0,0|1,0,0]=3 3901 B10R1.25 O=Cc1ccc(cc1Cl)C 1P0037UK [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.25 O=Cc1ccc(cc1Cl)Cl 1P003G7P [1,1,0,0,0,0|1,0,0]=3 3903 B10R1.25 O=Cc1ccc(cc1Cl)F 1P0033OI [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.25 O=Cc1ccc(cc1Cl)I 1P01B92Q [1,1,0,0,0,0|1,0,0]=3 3905 B10R1.25 O=Cc1ccc(cc1Cl)N 1P00CLTP [1,1,0,0,0,0|1,0,0]=3 3906 B10R1.25 O=Cc1ccc(cc1Cl)O 1P003HDY [1,1,0,0,0,0|1,0,0]=3 3907 B10R1.25 O=Cc1ccc(cc1F)Br 1P0034E1 [1,1,0,0,0,0|1,0,0]=3 3908 B10R1.25 O=Cc1ccc(cc1F)C 1P001E6N [1,1,0,0,0,0|1,0,0]=3 3909 B10R1.25 O=Cc1ccc(cc1F)Cl 1P0034FU [1,1,0,0,0,0|1,0,0]=3 3910 B10R1.25 O=Cc1ccc(cc1F)F 1P001O01 [1,1,0,0,0,0|1,0,0]=3 3911 B10R1.25 O=Cc1ccc(cc1F)I 1P005HIY [1,1,0,0,0,0|1,0,0]=3 3912 B10R1.25 O=Cc1ccc(cc1F)O 1P00399R [1,1,0,0,0,0|1,0,0]=3 3913 B10R1.25 O=Cc1ccc(cc1I)Br 1P000S8T [1,1,0,0,0,0|1,0,0]=3 3914 B10R1.25 O=Cc1ccc(cc1I)F 1P00IGU0 [1,1,0,0,0,0|1,0,0]=3 3915 B10R1.25 O=Cc1ccc(cc1I)O 1P00IGHY [1,1,0,0,0,0|1,0,0]=3 3916 B10R1.25 O=Cc1ccc(cc1N)Br 1P003GVI [1,1,0,0,0,0|1,0,0]=3 3917 B10R1.25 O=Cc1ccc(cc1N)C 1P00EKG6 [1,1,0,0,0,0|1,0,0]=3 3918 B10R1.25 O=Cc1ccc(cc1N)Cl 1P00EIVE [1,1,0,0,0,0|1,0,0]=3 3919 B10R1.25 O=Cc1ccc(cc1N)F 1P00ACNM [1,1,0,0,0,0|1,0,0]=3 3920 B10R1.25 O=Cc1ccc(cc1N)I 1P000S1L [1,1,0,0,0,0|1,0,0]=3 3921 B10R1.25 O=Cc1ccc(cc1N)N 1P0069AI [1,1,0,0,0,0|1,0,0]=3 3922 B10R1.25 O=Cc1ccc(cc1O)Br 1P0034E5 [1,1,0,0,0,0|0,0,0]=2 3923 B10R1.25 O=Cc1ccc(cc1O)C 1P003HV7 [1,1,0,0,0,0|0,0,0]=2 3924 B10R1.25 O=Cc1ccc(cc1O)Cl 1P003LK0 [1,1,0,0,0,0|0,0,0]=2 3925 B10R1.25 O=Cc1ccc(cc1O)F 1P003LTP [1,1,0,0,0,0|0,0,0]=2 3926 B10R1.25 O=Cc1ccc(cc1O)I 1P00C5SA [1,1,0,0,0,0|0,0,0]=2 3927 B10R1.25 O=Cc1ccc(cc1O)O 1P0033G6 [1,1,0,0,0,0|0,0,0]=2 3928 B10R1.25 O=Cc1ncc(cc1Br)Br 1P0033ZT [1,1,0,0,0,0|2,0,0]=4 3929 B10R1.25 O=Cc1ncc(cc1Br)Cl 1P000JU8 [1,1,0,0,0,0|2,0,0]=4 3930 B10R1.25 O=Cc1ncc(cc1Br)F 1P009YR2 [1,1,0,0,0,0|2,0,0]=4 3931 B10R1.25 O=Cc1ncc(cc1C)Br 1P00C05K [1,1,0,0,0,0|2,0,0]=4 3932 B10R1.25 O=Cc1ncc(cc1C)C 1P00FEVE [1,1,0,0,0,0|2,0,0]=4 3933 B10R1.25 O=Cc1ncc(cc1C)F 1P00GAS8 [1,1,0,0,0,0|2,0,0]=4 3934 B10R1.25 O=Cc1ncc(cc1Cl)Br 1P0049AP [1,1,0,0,0,0|2,0,0]=4 3935 B10R1.25 O=Cc1ncc(cc1Cl)C 1P024DTT [1,1,0,0,0,0|2,0,0]=4 3936 B10R1.25 O=Cc1ncc(cc1Cl)Cl 1P00DIBZ [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.25 O=Cc1ncc(cc1F)Br 1P0036LQ [1,1,0,0,0,0|2,0,0]=4 3938 B10R1.25 O=Cc1ncc(cc1F)C 1P01XC2W [1,1,0,0,0,0|2,0,0]=4 3939 B10R1.25 O=Cc1ncc(cc1F)Cl 1P00BFQO [1,1,0,0,0,0|2,0,0]=4 3940 B10R1.25 O=Cc1ncc(cc1F)F 1P00GA63 [1,1,0,0,0,0|2,0,0]=4 3941 B10R1.25 O=Cc1ncc(cc1I)Br 1P027U20 [1,1,0,0,0,0|2,0,0]=4 3942 B10R1.25 O=Cc1ncc(cc1N)Br 1P000YZV [1,1,0,0,0,0|2,0,0]=4 3943 B10R1.25 O=Cc1ncc(cc1N)F 1P00A3U4 [1,1,0,0,0,0|2,0,0]=4 3944 B10R1.25 O=Cc1ncc(cc1O)Br 1P000JTE [1,1,0,0,0,0|1,0,0]=3 3945 B10R1.25 O=Nc1ccc(cc1Br)O 1P027XKP [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.25 OCc1ccc(cc1Br)Br 1P00FC1F [1,1,0,0,0,0|1,0,1]=4 3947 B10R1.25 OCc1ccc(cc1Br)Cl 1P00AOGF [1,1,0,0,0,0|1,0,1]=4 3948 B10R1.25 OCc1ccc(cc1Br)F 1P002LVJ [1,1,0,0,0,0|1,0,1]=4 3949 B10R1.25 OCc1ccc(cc1Br)I 1P000SEI [1,1,0,0,0,0|1,0,1]=4 3950 B10R1.25 OCc1ccc(cc1Br)O 1P01FPD9 [1,1,0,0,0,0|1,0,1]=4 3951 B10R1.25 OCc1ccc(cc1C)Br 1P00AKVA [1,1,0,0,0,0|1,0,1]=4 3952 B10R1.25 OCc1ccc(cc1C)C 1P001U4P [1,1,0,0,0,0|1,0,1]=4 3953 B10R1.25 OCc1ccc(cc1C)Cl 1P000U21 [1,1,0,0,0,0|1,0,1]=4 3954 B10R1.25 OCc1ccc(cc1C)F 1P005D19 [1,1,0,0,0,0|1,0,1]=4 3955 B10R1.25 OCc1ccc(cc1C)N 1P00IBO5 [1,1,0,0,0,0|1,0,1]=4 3956 B10R1.25 OCc1ccc(cc1Cl)Br 1P007TZT [1,1,0,0,0,0|1,0,1]=4 3957 B10R1.25 OCc1ccc(cc1Cl)C 1P00CNT6 [1,1,0,0,0,0|1,0,1]=4 3958 B10R1.25 OCc1ccc(cc1Cl)Cl 1P0025XP [1,1,0,0,0,0|1,0,1]=4 3959 B10R1.25 OCc1ccc(cc1Cl)F 1P002K10 [1,1,0,0,0,0|1,0,1]=4 3960 B10R1.25 OCc1ccc(cc1Cl)I 1P00A15B [1,1,0,0,0,0|1,0,1]=4 3961 B10R1.25 OCc1ccc(cc1Cl)N 1P00DKM5 [1,1,0,0,0,0|1,0,1]=4 3962 B10R1.25 OCc1ccc(cc1Cl)O 1P00AT27 [1,1,0,0,0,0|1,0,1]=4 3963 B10R1.25 OCc1ccc(cc1F)Br 1P002HGY [1,1,0,0,0,0|1,0,1]=4 3964 B10R1.25 OCc1ccc(cc1F)C 1P002RC2 [1,1,0,0,0,0|1,0,1]=4 3965 B10R1.25 OCc1ccc(cc1F)Cl 1P0037O7 [1,1,0,0,0,0|1,0,1]=4 3966 B10R1.25 OCc1ccc(cc1F)F 1P003G98 [1,1,0,0,0,0|1,0,1]=4 3967 B10R1.25 OCc1ccc(cc1F)I 1P0091SJ [1,1,0,0,0,0|1,0,1]=4 3968 B10R1.25 OCc1ccc(cc1F)N 1P00511J [1,1,0,0,0,0|1,0,1]=4 3969 B10R1.25 OCc1ccc(cc1F)O 1P00IKBI [1,1,0,0,0,0|1,0,1]=4 3970 B10R1.25 OCc1ccc(cc1I)Br 1P000S73 [1,1,0,0,0,0|1,0,1]=4 3971 B10R1.25 OCc1ccc(cc1I)Cl 1P01BG3B [1,1,0,0,0,0|1,0,1]=4 3972 B10R1.25 OCc1ccc(cc1N)Br 1P0069W9 [1,1,0,0,0,0|1,0,1]=4 3973 B10R1.25 OCc1ccc(cc1N)C 1P0053KF [1,1,0,0,0,0|1,0,1]=4 3974 B10R1.25 OCc1ccc(cc1N)Cl 1P00CLS1 [1,1,0,0,0,0|1,0,1]=4 3975 B10R1.25 OCc1ccc(cc1N)F 1P002BH1 [1,1,0,0,0,0|1,0,1]=4 3976 B10R1.25 OCc1ccc(cc1O)Br 1P00ACKI [1,1,0,0,0,0|0,0,1]=3 3977 B10R1.25 OCc1ccc(cc1O)F 1P00G9UM [1,1,0,0,0,0|0,0,1]=3 3978 B10R1.30 BrCc1cc(F)ccc1O 1P00HJC1 [1,1,0,0,0,0|1,0,1]=4 3979 B10R1.30 C#Cc1cc(N)ccc1O 1P009GC0 [1,1,0,0,0,0|1,0,1]=4 3980 B10R1.30 C=Cc1cc(Br)ccc1Cl 1P01C7QH [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.30 C=Cc1cc(Br)ccc1F 1P00I4ST [1,1,0,0,0,0|2,0,0]=4 3982 B10R1.30 C=Cc1cc(C)ccc1C 1P0029NY [1,1,0,0,0,0|2,0,0]=4 3983 B10R1.30 C=Cc1cc(Cl)ccc1Br 1P01C4T1 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.30 C=Cc1cc(F)ccc1Br 1P008IRD [1,1,0,0,0,0|2,0,0]=4 3985 B10R1.30 CCc1cc(Br)ccc1O 1P002EFG [1,1,0,0,0,0|1,0,1]=4 3986 B10R1.30 CCc1cc(C)ccc1O 1P00CV2C [1,1,0,0,0,0|1,0,1]=4 3987 B10R1.30 CCc1cc(F)ccc1O 1P00C72H [1,1,0,0,0,0|1,0,1]=4 3988 B10R1.30 CCc1cc(O)ccc1O 1P002NUU [1,1,0,0,0,0|1,0,1]=4 3989 B10R1.30 CNc1cc(O)ccc1O 1P007HJ6 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.30 COc1cc(Br)ccc1O 1P003LDR [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.30 COc1cc(C)ccc1O 1P00IHWN [1,1,0,0,0,0|2,0,0]=4 3992 B10R1.30 COc1cc(Cl)ccc1O 1P003LKA [1,1,0,0,0,0|2,0,0]=4 3993 B10R1.30 COc1cc(F)ccc1O 1P003LTV [1,1,0,0,0,0|2,0,0]=4 3994 B10R1.30 COc1cc(I)ccc1O 1P0029MI [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.30 COc1cc(N)ccc1O 1P003887 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.30 COc1cc(N)ccc1O 1P00DFCA [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.30 COc1cc(O)ccc1O 1P003BPJ [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.30 CSc1cc(Br)ccc1O 1P0291UR [1,1,0,0,0,0|2,0,0]=4 3999 B10R1.30 CSc1cc(F)ccc1O 1P01JFRT [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.30 N#Cc1cc(Br)ccc1O 1P003MXX [1,1,0,0,0,0|1,0,1]=4 4001 B10R1.30 N#Cc1cc(C)ccc1O 1P00DLHV [1,1,0,0,0,0|1,0,1]=4 4002 B10R1.30 N#Cc1cc(Cl)ccc1O 1P009BLM [1,1,0,0,0,0|1,0,1]=4 4003 B10R1.30 N#Cc1cc(F)ccc1O 1P006NOL [1,1,0,0,0,0|1,0,1]=4 4004 B10R1.30 N#Cc1cc(I)ccc1O 1P00FB5S [1,1,0,0,0,0|1,0,1]=4 4005 B10R1.30 N#Cc1cc(N)ccc1O 1P004H3U [1,1,0,0,0,0|1,0,1]=4 4006 B10R1.30 NCc1cc(Br)ccc1O 1P00EJ2Z [1,1,0,0,0,0|1,0,1]=4 4007 B10R1.30 NCc1cc(Br)ccc1O 1P01BAPQ [1,1,0,0,0,0|1,0,1]=4 4008 B10R1.30 NCc1cc(C)ccc1O 1P01BVD4 [1,1,0,0,0,0|1,0,1]=4 4009 B10R1.30 NCc1cc(Cl)ccc1O 1P01A90D [1,1,0,0,0,0|1,0,1]=4 4010 B10R1.30 NCc1cc(F)ccc1O 1P01BU6H [1,1,0,0,0,0|1,0,1]=4 4011 B10R1.30 NCc1cc(F)ccc1O 1P01BU6I [1,1,0,0,0,0|1,0,1]=4 4012 B10R1.30 NCc1cc(N)ccc1O 1P01BIE1 [1,1,0,0,0,0|1,0,1]=4 4013 B10R1.30 O=Cc1cc(=O)[nH]cc1Br 1P000JR8 [1,1,0,0,0,0|2,0,0]=4 4014 B10R1.30 O=Cc1cc(Br)c[nH]c1=O 1P01FPCR [1,1,0,0,0,0|1,0,1]=4 4015 B10R1.30 O=Cc1cc(Br)ccc1Br 1P003GDG [1,1,0,0,0,0|1,0,0]=3 4016 B10R1.30 O=Cc1cc(Br)ccc1C 1P00IGGA [1,1,0,0,0,0|1,0,0]=3 4017 B10R1.30 O=Cc1cc(Br)ccc1Cl 1P002EA5 [1,1,0,0,0,0|1,0,0]=3 4018 B10R1.30 O=Cc1cc(Br)ccc1F 1P0034OA [1,1,0,0,0,0|1,0,0]=3 4019 B10R1.30 O=Cc1cc(Br)ccc1I 1P006FSM [1,1,0,0,0,0|1,0,0]=3 4020 B10R1.30 O=Cc1cc(Br)ccc1N 1P002XVF [1,1,0,0,0,0|1,0,0]=3 4021 B10R1.30 O=Cc1cc(Br)ccc1O 1P0021WD [1,1,0,0,0,0|0,0,0]=2 4022 B10R1.30 O=Cc1cc(Br)cnc1Br 1P004QPV [1,1,0,0,0,0|2,0,0]=4 4023 B10R1.30 O=Cc1cc(Br)cnc1Cl 1P0036M3 [1,1,0,0,0,0|2,0,0]=4 4024 B10R1.30 O=Cc1cc(Br)cnc1F 1P003MXS [1,1,0,0,0,0|2,0,0]=4 4025 B10R1.30 O=Cc1cc(Br)cnc1N 1P002J9J [1,1,0,0,0,0|2,0,0]=4 4026 B10R1.30 O=Cc1cc(Br)ncc1Br 1P006ALS [1,1,0,0,0,0|2,0,0]=4 4027 B10R1.30 O=Cc1cc(Br)ncc1Cl 1P00H03I [1,1,0,0,0,0|2,0,0]=4 4028 B10R1.30 O=Cc1cc(Br)ncc1F 1P0002QG [1,1,0,0,0,0|2,0,0]=4 4029 B10R1.30 O=Cc1cc(Br)ncc1N 1P01JWOU [1,1,0,0,0,0|2,0,0]=4 4030 B10R1.30 O=Cc1cc(Br)ncc1O 1P000PQC [1,1,0,0,0,0|1,0,0]=3 4031 B10R1.30 O=Cc1cc(C)c[nH]c1=O 1P000JSY [1,1,0,0,0,0|1,0,1]=4 4032 B10R1.30 O=Cc1cc(C)ccc1Br 1P006J4R [1,1,0,0,0,0|1,0,0]=3 4033 B10R1.30 O=Cc1cc(C)ccc1C 1P003GGC [1,1,0,0,0,0|1,0,0]=3 4034 B10R1.30 O=Cc1cc(C)ccc1Cl 1P001MDA [1,1,0,0,0,0|1,0,0]=3 4035 B10R1.30 O=Cc1cc(C)ccc1F 1P00GRQF [1,1,0,0,0,0|1,0,0]=3 4036 B10R1.30 O=Cc1cc(C)ccc1I 1P008UB7 [1,1,0,0,0,0|1,0,0]=3 4037 B10R1.30 O=Cc1cc(C)ccc1O 1P003ND7 [1,1,0,0,0,0|0,0,0]=2 4038 B10R1.30 O=Cc1cc(C)cnc1Br 1P000JSN [1,1,0,0,0,0|2,0,0]=4 4039 B10R1.30 O=Cc1cc(C)cnc1Cl 1P00GSJ7 [1,1,0,0,0,0|2,0,0]=4 4040 B10R1.30 O=Cc1cc(C)cnc1F 1P000C3M [1,1,0,0,0,0|2,0,0]=4 4041 B10R1.30 O=Cc1cc(C)cnc1N 1P0007RT [1,1,0,0,0,0|2,0,0]=4 4042 B10R1.30 O=Cc1cc(C)ncc1Br 1P00OENT [1,1,0,0,0,0|2,0,0]=4 4043 B10R1.30 O=Cc1cc(Cl)c[nH]c1=O 1P00ISIE [1,1,0,0,0,0|1,0,1]=4 4044 B10R1.30 O=Cc1cc(Cl)ccc1Br 1P00200C [1,1,0,0,0,0|1,0,0]=3 4045 B10R1.30 O=Cc1cc(Cl)ccc1C 1P00EKCM [1,1,0,0,0,0|1,0,0]=3 4046 B10R1.30 O=Cc1cc(Cl)ccc1Cl 1P003GDT [1,1,0,0,0,0|1,0,0]=3 4047 B10R1.30 O=Cc1cc(Cl)ccc1F 1P003N31 [1,1,0,0,0,0|1,0,0]=3 4048 B10R1.30 O=Cc1cc(Cl)ccc1I 1P01B7EX [1,1,0,0,0,0|1,0,0]=3 4049 B10R1.30 O=Cc1cc(Cl)ccc1N 1P002D3Z [1,1,0,0,0,0|1,0,0]=3 4050 B10R1.30 O=Cc1cc(Cl)ccc1O 1P0034PJ [1,1,0,0,0,0|0,0,0]=2 4051 B10R1.30 O=Cc1cc(Cl)cnc1Br 1P000JVB [1,1,0,0,0,0|2,0,0]=4 4052 B10R1.30 O=Cc1cc(Cl)cnc1C 1P007WDD [1,1,0,0,0,0|2,0,0]=4 4053 B10R1.30 O=Cc1cc(Cl)cnc1Cl 1P00254W [1,1,0,0,0,0|2,0,0]=4 4054 B10R1.30 O=Cc1cc(Cl)cnc1F 1P004AFK [1,1,0,0,0,0|2,0,0]=4 4055 B10R1.30 O=Cc1cc(Cl)cnc1N 1P00DCAO [1,1,0,0,0,0|2,0,0]=4 4056 B10R1.30 O=Cc1cc(Cl)ncc1Br 1P007ELN [1,1,0,0,0,0|2,0,0]=4 4057 B10R1.30 O=Cc1cc(Cl)ncc1Cl 1P0008H9 [1,1,0,0,0,0|2,0,0]=4 4058 B10R1.30 O=Cc1cc(Cl)ncc1F 1P008D47 [1,1,0,0,0,0|2,0,0]=4 4059 B10R1.30 O=Cc1cc(Cl)ncc1O 1P0094GE [1,1,0,0,0,0|1,0,0]=3 4060 B10R1.30 O=Cc1cc(F)c[nH]c1=O 1P00H32F [1,1,0,0,0,0|1,0,1]=4 4061 B10R1.30 O=Cc1cc(F)ccc1Br 1P0033M9 [1,1,0,0,0,0|1,0,0]=3 4062 B10R1.30 O=Cc1cc(F)ccc1C 1P003N7R [1,1,0,0,0,0|1,0,0]=3 4063 B10R1.30 O=Cc1cc(F)ccc1Cl 1P003HF9 [1,1,0,0,0,0|1,0,0]=3 4064 B10R1.30 O=Cc1cc(F)ccc1F 1P002TSH [1,1,0,0,0,0|1,0,0]=3 4065 B10R1.30 O=Cc1cc(F)ccc1I 1P0036H1 [1,1,0,0,0,0|1,0,0]=3 4066 B10R1.30 O=Cc1cc(F)ccc1N 1P001ETV [1,1,0,0,0,0|1,0,0]=3 4067 B10R1.30 O=Cc1cc(F)ccc1O 1P0034QA [1,1,0,0,0,0|0,0,0]=2 4068 B10R1.30 O=Cc1cc(F)cnc1Br 1P0202G5 [1,1,0,0,0,0|2,0,0]=4 4069 B10R1.30 O=Cc1cc(F)cnc1Cl 1P004X9P [1,1,0,0,0,0|2,0,0]=4 4070 B10R1.30 O=Cc1cc(F)ncc1F 1P01BBJW [1,1,0,0,0,0|2,0,0]=4 4071 B10R1.30 O=Cc1cc(I)ccc1Br 1P0086ED [1,1,0,0,0,0|1,0,0]=3 4072 B10R1.30 O=Cc1cc(I)ccc1Cl 1P01FFK9 [1,1,0,0,0,0|1,0,0]=3 4073 B10R1.30 O=Cc1cc(I)ccc1F 1P001E6Q [1,1,0,0,0,0|1,0,0]=3 4074 B10R1.30 O=Cc1cc(I)ccc1O 1P0021WC [1,1,0,0,0,0|0,0,0]=2 4075 B10R1.30 O=Cc1cc(I)cnc1N 1P003GXT [1,1,0,0,0,0|2,0,0]=4 4076 B10R1.30 O=Cc1cc(I)ncc1Br 1P01KL50 [1,1,0,0,0,0|2,0,0]=4 4077 B10R1.30 O=Cc1cc(O)ccc1Br 1P002ZPG [1,1,0,0,0,0|1,0,0]=3 4078 B10R1.30 O=Cc1cc(O)ccc1C 1P00BJ2G [1,1,0,0,0,0|1,0,0]=3 4079 B10R1.30 O=Cc1cc(O)ccc1Cl 1P0036ZY [1,1,0,0,0,0|1,0,0]=3 4080 B10R1.30 O=Cc1cc(O)ccc1F 1P0038TJ [1,1,0,0,0,0|1,0,0]=3 4081 B10R1.30 O=Cc1cc(O)ccc1I 1P006WAN [1,1,0,0,0,0|1,0,0]=3 4082 B10R1.30 O=Cc1cc(O)ccc1O 1P000J5W [1,1,0,0,0,0|0,0,0]=2 4083 B10R1.30 O=Cc1nc(Br)ccc1Br 1P009YJH [1,1,0,0,0,0|2,0,0]=4 4084 B10R1.30 O=Cc1nc(Br)ccc1C 1P021VWE [1,1,0,0,0,0|2,0,0]=4 4085 B10R1.30 O=Cc1nc(Br)ccc1Cl 1P0092BQ [1,1,0,0,0,0|2,0,0]=4 4086 B10R1.30 O=Cc1nc(Br)ccc1F 1P0047LH [1,1,0,0,0,0|2,0,0]=4 4087 B10R1.30 O=Cc1nc(Br)ccc1N 1P024SL4 [1,1,0,0,0,0|2,0,0]=4 4088 B10R1.30 O=Cc1nc(C)ccc1Br 1P01K5U2 [1,1,0,0,0,0|2,0,0]=4 4089 B10R1.30 O=Cc1nc(C)ccc1Cl 1P01EEM4 [1,1,0,0,0,0|2,0,0]=4 4090 B10R1.30 O=Cc1nc(C)ccc1F 1P0036LA [1,1,0,0,0,0|2,0,0]=4 4091 B10R1.30 O=Cc1nc(C)ccc1O 1P00FDMQ [1,1,0,0,0,0|1,0,0]=3 4092 B10R1.30 O=Cc1nc(Cl)ccc1Br 1P008WUA [1,1,0,0,0,0|2,0,0]=4 4093 B10R1.30 O=Cc1nc(Cl)ccc1Cl 1P00C7KW [1,1,0,0,0,0|2,0,0]=4 4094 B10R1.30 O=Cc1nc(Cl)ccc1F 1P008D44 [1,1,0,0,0,0|2,0,0]=4 4095 B10R1.30 O=Cc1nc(Cl)ccc1N 1P0081CH [1,1,0,0,0,0|2,0,0]=4 4096 B10R1.30 O=Cc1nc(F)ccc1Br 1P01FLZC [1,1,0,0,0,0|2,0,0]=4 4097 B10R1.30 O=Cc1nc(F)ccc1F 1P009D4T [1,1,0,0,0,0|2,0,0]=4 4098 B10R1.30 OC1=CC=C(Br)C(CO)=C1 1P01KEVA [1,1,0,0,0,0|1,0,1]=4 4099 B10R1.30 OCC1=CC(=O)C=CC1=O 1P00EZ49 [1,1,0,0,0,0|0,0,2]=4 4100 B10R1.30 OCc1cc(Br)ccc1Br 1P001F0V [1,1,0,0,0,0|1,0,1]=4 4101 B10R1.30 OCc1cc(Br)ccc1C 1P007NZN [1,1,0,0,0,0|1,0,1]=4 4102 B10R1.30 OCc1cc(Br)ccc1Cl 1P001MME [1,1,0,0,0,0|1,0,1]=4 4103 B10R1.30 OCc1cc(Br)ccc1F 1P00659D [1,1,0,0,0,0|1,0,1]=4 4104 B10R1.30 OCc1cc(Br)ccc1I 1P002CS9 [1,1,0,0,0,0|1,0,1]=4 4105 B10R1.30 OCc1cc(Br)ccc1N 1P002JC4 [1,1,0,0,0,0|1,0,1]=4 4106 B10R1.30 OCc1cc(Br)ccc1O 1P002MVK [1,1,0,0,0,0|0,0,1]=3 4107 B10R1.30 OCc1cc(C)ccc1Br 1P00FHKQ [1,1,0,0,0,0|1,0,1]=4 4108 B10R1.30 OCc1cc(C)ccc1C 1P0033H8 [1,1,0,0,0,0|1,0,1]=4 4109 B10R1.30 OCc1cc(C)ccc1Cl 1P00IGDX [1,1,0,0,0,0|1,0,1]=4 4110 B10R1.30 OCc1cc(C)ccc1F 1P00EC6U [1,1,0,0,0,0|1,0,1]=4 4111 B10R1.30 OCc1cc(C)ccc1I 1P00BFVA [1,1,0,0,0,0|1,0,1]=4 4112 B10R1.30 OCc1cc(C)ccc1N 1P003GY0 [1,1,0,0,0,0|1,0,1]=4 4113 B10R1.30 OCc1cc(C)ccc1O 1P0039V2 [1,1,0,0,0,0|0,0,1]=3 4114 B10R1.30 OCc1cc(Cl)ccc1Br 1P0033M7 [1,1,0,0,0,0|1,0,1]=4 4115 B10R1.30 OCc1cc(Cl)ccc1C 1P00EKFC [1,1,0,0,0,0|1,0,1]=4 4116 B10R1.30 OCc1cc(Cl)ccc1Cl 1P003GE2 [1,1,0,0,0,0|1,0,1]=4 4117 B10R1.30 OCc1cc(Cl)ccc1F 1P002HOR [1,1,0,0,0,0|1,0,1]=4 4118 B10R1.30 OCc1cc(Cl)ccc1I 1P008KGY [1,1,0,0,0,0|1,0,1]=4 4119 B10R1.30 OCc1cc(Cl)ccc1N 1P003GXH [1,1,0,0,0,0|1,0,1]=4 4120 B10R1.30 OCc1cc(Cl)ccc1O 1P00D963 [1,1,0,0,0,0|0,0,1]=3 4121 B10R1.30 OCc1cc(F)ccc1Br 1P0028Y4 [1,1,0,0,0,0|1,0,1]=4 4122 B10R1.30 OCc1cc(F)ccc1C 1P00711X [1,1,0,0,0,0|1,0,1]=4 4123 B10R1.30 OCc1cc(F)ccc1Cl 1P002SHQ [1,1,0,0,0,0|1,0,1]=4 4124 B10R1.30 OCc1cc(F)ccc1F 1P003BLW [1,1,0,0,0,0|1,0,1]=4 4125 B10R1.30 OCc1cc(F)ccc1I 1P004GRY [1,1,0,0,0,0|1,0,1]=4 4126 B10R1.30 OCc1cc(F)ccc1N 1P0058SK [1,1,0,0,0,0|1,0,1]=4 4127 B10R1.30 OCc1cc(F)ccc1O 1P002O5T [1,1,0,0,0,0|0,0,1]=3 4128 B10R1.30 OCc1cc(I)ccc1Br 1P00H66P [1,1,0,0,0,0|1,0,1]=4 4129 B10R1.30 OCc1cc(I)ccc1C 1P009D68 [1,1,0,0,0,0|1,0,1]=4 4130 B10R1.30 OCc1cc(I)ccc1Cl 1P00HAJV [1,1,0,0,0,0|1,0,1]=4 4131 B10R1.30 OCc1cc(I)ccc1F 1P00JYGL [1,1,0,0,0,0|1,0,1]=4 4132 B10R1.30 OCc1cc(I)ccc1N 1P00DL6D [1,1,0,0,0,0|1,0,1]=4 4133 B10R1.30 OCc1cc(I)ccc1O 1P009D8D [1,1,0,0,0,0|0,0,1]=3 4134 B10R1.30 OCc1cc(N)ccc1Br 1P00G9UP [1,1,0,0,0,0|1,0,1]=4 4135 B10R1.30 OCc1cc(N)ccc1Cl 1P0034NE [1,1,0,0,0,0|1,0,1]=4 4136 B10R1.30 OCc1cc(N)ccc1F 1P008GPU [1,1,0,0,0,0|1,0,1]=4 4137 B10R1.30 OCc1cc(N)ccc1O 1P007YNM [1,1,0,0,0,0|0,0,1]=3 4138 B10R1.30 OCc1cc(O)ccc1C 1P000S7T [1,1,0,0,0,0|1,0,1]=4 4139 B10R1.30 OCc1cc(O)ccc1Cl 1P00H4CV [1,1,0,0,0,0|1,0,1]=4 4140 B10R1.30 OCc1cc(O)ccc1F 1P00DBWH [1,1,0,0,0,0|1,0,1]=4 4141 B10R1.30 OCc1nc(C)ccc1O 1P003FJ8 [1,1,0,0,0,0|1,0,1]=4 4142 B10R1.245 C=Cc1c(Br)ccnc1O 1P00ILLH [1,1,0,0,0,0|2,0,0]=4 4143 B10R1.245 C=Cc1c(C)cccc1C 1P0029NX [1,1,0,0,0,0|2,0,0]=4 4144 B10R1.245 C=Cc1c(Cl)cccc1Cl 1P002VWT [1,1,0,0,0,0|2,0,0]=4 4145 B10R1.245 C=Cc1c(Cl)ccnc1O 1P00ILVG [1,1,0,0,0,0|2,0,0]=4 4146 B10R1.245 C=Cc1c(F)cccc1Br 1P01C7QK [1,1,0,0,0,0|2,0,0]=4 4147 B10R1.245 C=Cc1c(F)cccc1Cl 1P007RK3 [1,1,0,0,0,0|2,0,0]=4 4148 B10R1.245 C=Cc1c(F)cccc1F 1P002JDQ [1,1,0,0,0,0|2,0,0]=4 4149 B10R1.245 C=Cc1c(F)ccnc1O 1P00ILLA [1,1,0,0,0,0|2,0,0]=4 4150 B10R1.245 C=Cc1c(I)ccnc1O 1P00IL4V [1,1,0,0,0,0|2,0,0]=4 4151 B10R1.245 CCc1c(O)cccc1Cl 1P028XUE [1,1,0,0,0,0|1,0,1]=4 4152 B10R1.245 CCc1c(O)cccc1F 1P0287Y4 [1,1,0,0,0,0|1,0,1]=4 4153 B10R1.245 CNc1c(O)cccc1F 1P028KD5 [1,1,0,0,0,0|2,0,0]=4 4154 B10R1.245 COc1c(N)cccc1O 1P00A36X [1,1,0,0,0,0|2,0,0]=4 4155 B10R1.245 COc1c(O)cccc1Br 1P004AQO [1,1,0,0,0,0|2,0,0]=4 4156 B10R1.245 COc1c(O)cccc1Cl 1P00GABT [1,1,0,0,0,0|2,0,0]=4 4157 B10R1.245 CSc1c(C)cccc1O 1P00HAIM [1,1,0,0,0,0|2,0,0]=4 4158 B10R1.245 N#Cc1c(C)cccc1O 1P00FELV [1,1,0,0,0,0|1,0,1]=4 4159 B10R1.245 N#Cc1c(N)cccc1O 1P01JZVM [1,1,0,0,0,0|1,0,1]=4 4160 B10R1.245 N#Cc1c(O)cccc1Br 1P00376V [1,1,0,0,0,0|1,0,1]=4 4161 B10R1.245 N#Cc1c(O)cccc1Cl 1P0033PH [1,1,0,0,0,0|1,0,1]=4 4162 B10R1.245 N#Cc1c(O)cccc1F 1P001D54 [1,1,0,0,0,0|1,0,1]=4 4163 B10R1.245 NCc1c(O)cccc1Br 1P01FIB7 [1,1,0,0,0,0|1,0,1]=4 4164 B10R1.245 NCc1c(O)cccc1Cl 1P01B9QA [1,1,0,0,0,0|1,0,1]=4 4165 B10R1.245 NCc1c(O)cccc1O 1P01EIMG [1,1,0,0,0,0|1,0,1]=4 4166 B10R1.245 O=Cc1c(Br)cc[nH]c1=O 1P02057N [1,1,0,0,0,0|1,0,1]=4 4167 B10R1.245 O=Cc1c(Br)cccc1Br 1P006KNH [1,1,0,0,0,0|1,0,0]=3 4168 B10R1.245 O=Cc1c(Br)ccnc1Br 1P000Y6V [1,1,0,0,0,0|2,0,0]=4 4169 B10R1.245 O=Cc1c(Br)ccnc1Cl 1P000Y6X [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.245 O=Cc1c(Br)ccnc1F 1P000Y6Z [1,1,0,0,0,0|2,0,0]=4 4171 B10R1.245 O=Cc1c(Br)cncc1Br 1P0033ZS [1,1,0,0,0,0|2,0,0]=4 4172 B10R1.245 O=Cc1c(C)cccc1Br 1P002576 [1,1,0,0,0,0|1,0,0]=3 4173 B10R1.245 O=Cc1c(C)cccc1C 1P0033IJ [1,1,0,0,0,0|1,0,0]=3 4174 B10R1.245 O=Cc1c(C)cccc1Cl 1P000J6B [1,1,0,0,0,0|1,0,0]=3 4175 B10R1.245 O=Cc1c(C)cccc1F 1P003HRU [1,1,0,0,0,0|1,0,0]=3 4176 B10R1.245 O=Cc1c(C)cccc1N 1P01FXMP [1,1,0,0,0,0|1,0,0]=3 4177 B10R1.245 O=Cc1c(C)cccc1O 1P00288N [1,1,0,0,0,0|0,0,0]=2 4178 B10R1.245 O=Cc1c(C)ccnc1C 1P001Y87 [1,1,0,0,0,0|2,0,0]=4 4179 B10R1.245 O=Cc1c(C)cncc1C 1P002DRK [1,1,0,0,0,0|2,0,0]=4 4180 B10R1.245 O=Cc1c(Cl)cccc1Br 1P00ECVQ [1,1,0,0,0,0|1,0,0]=3 4181 B10R1.245 O=Cc1c(Cl)cccc1Cl 1P0033HV [1,1,0,0,0,0|1,0,0]=3 4182 B10R1.245 O=Cc1c(Cl)cccc1I 1P00DJHI [1,1,0,0,0,0|1,0,0]=3 4183 B10R1.245 O=Cc1c(Cl)ccnc1Br 1P000YZN [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.245 O=Cc1c(Cl)ccnc1Cl 1P0033FV [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.245 O=Cc1c(Cl)ccnc1F 1P000KOE [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.245 O=Cc1c(Cl)ccnc1N 1P00H3N8 [1,1,0,0,0,0|2,0,0]=4 4187 B10R1.245 O=Cc1c(Cl)cncc1Br 1P00HBA2 [1,1,0,0,0,0|2,0,0]=4 4188 B10R1.245 O=Cc1c(Cl)cncc1Cl 1P0012LA [1,1,0,0,0,0|2,0,0]=4 4189 B10R1.245 O=Cc1c(F)cccc1Br 1P003H7F [1,1,0,0,0,0|1,0,0]=3 4190 B10R1.245 O=Cc1c(F)cccc1Cl 1P0033PE [1,1,0,0,0,0|1,0,0]=3 4191 B10R1.245 O=Cc1c(F)cccc1F 1P0033I6 [1,1,0,0,0,0|1,0,0]=3 4192 B10R1.245 O=Cc1c(F)cccc1I 1P001E6S [1,1,0,0,0,0|1,0,0]=3 4193 B10R1.245 O=Cc1c(F)ccnc1Cl 1P01EANO [1,1,0,0,0,0|2,0,0]=4 4194 B10R1.245 O=Cc1c(F)ccnc1F 1P000JS3 [1,1,0,0,0,0|2,0,0]=4 4195 B10R1.245 O=Cc1c(F)ccnc1N 1P028J58 [1,1,0,0,0,0|2,0,0]=4 4196 B10R1.245 O=Cc1c(F)cncc1Br 1P009ISS [1,1,0,0,0,0|2,0,0]=4 4197 B10R1.245 O=Cc1c(F)cncc1Cl 1P009XZ1 [1,1,0,0,0,0|2,0,0]=4 4198 B10R1.245 O=Cc1c(F)cncc1F 1P004H48 [1,1,0,0,0,0|2,0,0]=4 4199 B10R1.245 O=Cc1c(F)cncc1I 1P027UOE [1,1,0,0,0,0|2,0,0]=4 4200 B10R1.245 O=Cc1c(I)ccnc1Cl 1P0038QP [1,1,0,0,0,0|2,0,0]=4 4201 B10R1.245 O=Cc1c(I)ccnc1F 1P0034JE [1,1,0,0,0,0|2,0,0]=4 4202 B10R1.245 O=Cc1c(N)cccc1Br 1P009DOW [1,1,0,0,0,0|1,0,0]=3 4203 B10R1.245 O=Cc1c(N)cccc1Cl 1P007BCI [1,1,0,0,0,0|1,0,0]=3 4204 B10R1.245 O=Cc1c(N)cccc1F 1P00ATGD [1,1,0,0,0,0|1,0,0]=3 4205 B10R1.245 O=Cc1c(N)cccc1I 1P01KLOP [1,1,0,0,0,0|1,0,0]=3 4206 B10R1.245 O=Cc1c(N)ccnc1Cl 1P00CL7G [1,1,0,0,0,0|2,0,0]=4 4207 B10R1.245 O=Cc1c(O)cccc1Br 1P0033MM [1,1,0,0,0,0|0,0,0]=2 4208 B10R1.245 O=Cc1c(O)cccc1Cl 1P00288O [1,1,0,0,0,0|0,0,0]=2 4209 B10R1.245 O=Cc1c(O)cccc1F 1P003HRJ [1,1,0,0,0,0|0,0,0]=2 4210 B10R1.245 O=Cc1c(O)cccc1O 1P0078N1 [1,1,0,0,0,0|0,0,0]=2 4211 B10R1.245 O=Cc1c(O)ccnc1Br 1P01XCSW [1,1,0,0,0,0|1,0,0]=3 4212 B10R1.245 O=Cc1c(O)cncc1Cl 1P01V8AR [1,1,0,0,0,0|1,0,0]=3 4213 B10R1.245 O=Cc1c(O)ncnc1O 1P006YPA [1,1,0,0,0,0|2,0,0]=4 4214 B10R1.245 O=Nc1c(Cl)cccc1Cl 1P000J69 [1,1,0,0,0,0|2,0,0]=4 4215 B10R1.245 OCc1c(Br)cccc1Br 1P0004NP [1,1,0,0,0,0|1,0,1]=4 4216 B10R1.245 OCc1c(C)cccc1Br 1P007ENR [1,1,0,0,0,0|1,0,1]=4 4217 B10R1.245 OCc1c(C)cccc1C 1P00IBGS [1,1,0,0,0,0|1,0,1]=4 4218 B10R1.245 OCc1c(C)cccc1Cl 1P01B1SJ [1,1,0,0,0,0|1,0,1]=4 4219 B10R1.245 OCc1c(C)cccc1F 1P00DM67 [1,1,0,0,0,0|1,0,1]=4 4220 B10R1.245 OCc1c(C)cccc1N 1P00FGKX [1,1,0,0,0,0|1,0,1]=4 4221 B10R1.245 OCc1c(C)cccc1O 1P00BFUM [1,1,0,0,0,0|0,0,1]=3 4222 B10R1.245 OCc1c(Cl)cccc1Br 1P000M9H [1,1,0,0,0,0|1,0,1]=4 4223 B10R1.245 OCc1c(Cl)cccc1Cl 1P003GK2 [1,1,0,0,0,0|1,0,1]=4 4224 B10R1.245 OCc1c(F)cccc1Br 1P002SG4 [1,1,0,0,0,0|1,0,1]=4 4225 B10R1.245 OCc1c(F)cccc1Cl 1P003BO1 [1,1,0,0,0,0|1,0,1]=4 4226 B10R1.245 OCc1c(F)cccc1F 1P002F5R [1,1,0,0,0,0|1,0,1]=4 4227 B10R1.245 OCc1c(F)cccc1I 1P00H062 [1,1,0,0,0,0|1,0,1]=4 4228 B10R1.245 OCc1c(N)cccc1Br 1P00IEDG [1,1,0,0,0,0|1,0,1]=4 4229 B10R1.245 OCc1c(N)cccc1Cl 1P003GYV [1,1,0,0,0,0|1,0,1]=4 4230 B10R1.245 OCc1c(N)cccc1F 1P00C5I6 [1,1,0,0,0,0|1,0,1]=4 4231 B10R1.245 OCc1c(N)cccc1I 1P01B7E8 [1,1,0,0,0,0|1,0,1]=4 4232 B10R1.245 ONc1c(C)cccc1C 1P00328U [1,1,0,0,0,0|2,0,0]=4 4233 B10R1.39 BrCc1occc1C(=O)O 1P00HUYF [0,1,0,0,1,0|2,0,0]=4 4234 B10R1.39 CCc1[nH]ccc1C(=O)O 1P01BH8V [0,1,0,0,1,0|2,0,0]=4 4235 B10R1.39 CCc1c[nH]cc1C(=O)O 1P01DW0H [0,1,0,0,1,0|2,0,0]=4 4236 B10R1.39 CCc1ccoc1C(=O)O 1P01C5EG [0,1,0,0,1,0|2,0,0]=4 4237 B10R1.39 CCc1ccsc1C(=O)O 1P005GFH [0,1,0,0,1,0|2,0,0]=4 4238 B10R1.39 CCc1cscc1C(=O)O 1P007FPL [0,1,0,0,1,0|2,0,0]=4 4239 B10R1.39 CCc1sccc1C(=O)O 1P01BH5F [0,1,0,0,1,0|2,0,0]=4 4240 B10R1.39 CCn1cccc1C(=O)O 1P019VL1 [0,1,0,0,1,0|2,0,0]=4 4241 B10R1.39 COc1c[nH]nc1C(=O)O 1P028I89 [0,1,0,0,1,0|2,0,0]=4 4242 B10R1.39 COc1ccsc1C(=O)C 1P00DJQD [0,1,0,0,1,0|2,0,0]=4 4243 B10R1.39 COc1ccsc1C(=O)Cl 1P01BFQP [0,1,0,0,1,0|2,0,0]=4 4244 B10R1.39 COc1ccsc1C(=O)N 1P00GHE0 [0,1,0,0,1,0|2,0,0]=4 4245 B10R1.39 COc1ccsc1C(=O)O 1P00EAY2 [0,1,0,0,1,0|1,0,0]=3 4246 B10R1.39 COc1cscc1C(=O)O 1P005PGD [0,1,0,0,1,0|1,0,0]=3 4247 B10R1.39 COc1n[nH]cc1C(=O)O 1P01JUPV [0,1,0,0,1,0|2,0,0]=4 4248 B10R1.39 COc1nscc1C(=O)O 1P01AV4J [0,1,0,0,1,0|2,0,0]=4 4249 B10R1.39 CSc1ccsc1C(=O)O 1P01ABYI [0,1,0,0,1,0|1,1,0]=4 4250 B10R1.39 CSc1cscc1C(=O)O 1P0055VY [0,1,0,0,1,0|1,1,0]=4 4251 B10R1.39 CSc1sccc1C(=O)O 1P005XMR [0,1,0,0,1,0|1,1,0]=4 4252 B10R1.39 N#Cc1cc[nH]c1C(=O)O 1P00ICME [0,1,0,0,1,0|2,0,0]=4 4253 B10R1.39 N#Cc1ccsc1C(=O)O 1P01A8O0 [0,1,0,0,1,0|2,0,0]=4 4254 B10R1.39 N#Cc1cscc1C(=O)O 1P0055VW [0,1,0,0,1,0|2,0,0]=4 4255 B10R1.39 N#Cc1sccc1C(=O)O 1P00FGZY [0,1,0,0,1,0|2,0,0]=4 4256 B10R1.39 NCc1ccoc1C(=O)O 1P01AJRG [0,1,0,0,1,0|2,0,0]=4 4257 B10R1.39 NCc1ccsc1C(=O)O 1P01FIWQ [0,1,0,0,1,0|2,0,0]=4 4258 B10R1.39 NCc1occc1C(=O)O 1P01DXCX [0,1,0,0,1,0|2,0,0]=4 4259 B10R1.39 O=Cc1[nH]ccc1C(=O)O 1P00DLLL [0,1,0,0,1,0|1,0,1]=4 4260 B10R1.39 O=Cc1cc[nH]c1C(=O)O 1P0289C3 [0,1,0,0,1,0|1,0,1]=4 4261 B10R1.39 O=Cc1ccoc1C(=O)O 1P01ADPF [0,1,0,0,1,0|1,0,1]=4 4262 B10R1.39 O=Cc1ccsc1C(=O)O 1P002CWI [0,1,0,0,1,0|1,0,1]=4 4263 B10R1.39 O=Cc1cscc1C(=O)O 1P01B5XF [0,1,0,0,1,0|1,0,1]=4 4264 B10R1.39 O=Cc1occc1C(=O)O 1P00AR4D [0,1,0,0,1,0|1,0,1]=4 4265 B10R1.39 O=Cc1sccc1C(=O)O 1P002CWH [0,1,0,0,1,0|1,0,1]=4 4266 B10R1.39 OCc1ccsc1C(=O)O 1P01R06P [0,1,0,0,1,0|1,0,0]=3 4267 B10R1.39 SCc1occc1C(=O)O 1P01DZ8G [0,1,0,0,1,0|1,1,0]=4 4268 B10R1.59 Brc1cc(c(o1)C(=O)O)C 1P00ED7Z [0,1,0,0,1,0|2,0,0]=4 4269 B10R1.59 Brc1cc(c(s1)C(=O)O)Br 1P003J1Y [0,1,0,0,1,0|2,0,0]=4 4270 B10R1.59 Brc1cc(c(s1)C(=O)O)C 1P00C7LV [0,1,0,0,1,0|2,0,0]=4 4271 B10R1.59 Brc1cc(c(s1)C(=O)O)Cl 1P00G7I3 [0,1,0,0,1,0|2,0,0]=4 4272 B10R1.59 Brc1cc(c(s1)C(=O)O)F 1P009YT0 [0,1,0,0,1,0|2,0,0]=4 4273 B10R1.59 Brc1cc(c(s1)C(=O)O)I 1P01DWGE [0,1,0,0,1,0|2,0,0]=4 4274 B10R1.59 Brc1oc(c(c1)C(=O)O)C 1P004SZ7 [0,1,0,0,1,0|2,0,0]=4 4275 B10R1.59 Brc1sc(c(c1)C(=O)O)Br 1P003779 [0,1,0,0,1,0|2,0,0]=4 4276 B10R1.59 Brc1sc(c(c1)C(=O)O)C 1P009KMQ [0,1,0,0,1,0|2,0,0]=4 4277 B10R1.59 Brc1sc(c(c1)C(=O)O)Cl 1P002IS1 [0,1,0,0,1,0|2,0,0]=4 4278 B10R1.59 Brc1sc(c(c1)C(=O)O)I 1P028TMK [0,1,0,0,1,0|2,0,0]=4 4279 B10R1.59 Cc1cc(c(o1)C(=O)O)C 1P00C0J3 [0,1,0,0,1,0|2,0,0]=4 4280 B10R1.59 Cc1cc(c(s1)C(=O)O)Br 1P00IBAO [0,1,0,0,1,0|2,0,0]=4 4281 B10R1.59 Cc1cc(c(s1)C(=O)O)C 1P01BXXD [0,1,0,0,1,0|2,0,0]=4 4282 B10R1.59 Cc1cc(c(s1)C(=O)O)Cl 1P002M13 [0,1,0,0,1,0|2,0,0]=4 4283 B10R1.59 Cc1oc(c(c1)C(=O)O)Br 1P027V1N [0,1,0,0,1,0|2,0,0]=4 4284 B10R1.59 Cc1oc(c(c1)C(=O)O)C 1P00EAJZ [0,1,0,0,1,0|2,0,0]=4 4285 B10R1.59 Cc1sc(c(c1)C(=O)O)Br 1P00BKCX [0,1,0,0,1,0|2,0,0]=4 4286 B10R1.59 Cc1sc(c(c1)C(=O)O)C 1P002TMG [0,1,0,0,1,0|2,0,0]=4 4287 B10R1.59 Cc1sc(c(c1)C(=O)O)N 1P00C8MK [0,1,0,0,1,0|2,0,0]=4 4288 B10R1.59 Clc1cc(c(s1)C(=O)O)Br 1P00EM6B [0,1,0,0,1,0|2,0,0]=4 4289 B10R1.59 Clc1cc(c(s1)C(=O)O)Cl 1P00OFNI [0,1,0,0,1,0|2,0,0]=4 4290 B10R1.59 Clc1cc(c(s1)C(=O)O)I 1P028B72 [0,1,0,0,1,0|2,0,0]=4 4291 B10R1.59 Clc1sc(c(c1)C(=O)O)Br 1P024IA1 [0,1,0,0,1,0|2,0,0]=4 4292 B10R1.59 Clc1sc(c(c1)C(=O)O)Cl 1P003GEJ [0,1,0,0,1,0|2,0,0]=4 4293 B10R1.59 Cn1cc(c(c1)C(=O)O)C 1P00CYFK [0,1,0,0,1,0|2,0,0]=4 4294 B10R1.59 Cn1cc(cc1C(=O)O)Br 1P00H10B [0,1,0,0,1,0|2,0,0]=4 4295 B10R1.59 Cn1cc(cc1C(=O)O)Cl 1P00IF8G [0,1,0,0,1,0|2,0,0]=4 4296 B10R1.59 Cn1cc(cc1C(=O)O)F 1P00I0A9 [0,1,0,0,1,0|2,0,0]=4 4297 B10R1.59 Cn1cc(cc1C(=O)O)I 1P00IUST [0,1,0,0,1,0|2,0,0]=4 4298 B10R1.59 Fc1cc(c(s1)C(=O)O)Br 1P028EC9 [0,1,0,0,1,0|2,0,0]=4 4299 B10R1.59 Fc1cc(c(s1)C(=O)O)C 1P02870P [0,1,0,0,1,0|2,0,0]=4 4300 B10R1.59 Fc1cc(c(s1)C(=O)O)Cl 1P028SYW [0,1,0,0,1,0|2,0,0]=4 4301 B10R1.59 Ic1cc(c(s1)C(=O)O)Br 1P028B57 [0,1,0,0,1,0|2,0,0]=4 4302 B10R1.59 Ic1cc(c(s1)C(=O)O)Cl 1P028BAY [0,1,0,0,1,0|2,0,0]=4 4303 B10R1.59 OC(=O)c1[nH]c(cc1C)C 1P00I8YA [0,1,0,0,1,0|2,0,0]=4 4304 B10R1.59 OC(=O)c1cc([nH]c1C)C 1P00E9HR [0,1,0,0,1,0|2,0,0]=4 4305 B10R1.149 COC(=O)c1[nH]ccc1Br 1P003S8B [0,1,0,0,1,0|2,0,0]=4 4306 B10R1.149 COC(=O)c1[nH]ccc1C 1P00CMET [0,1,0,0,1,0|2,0,0]=4 4307 B10R1.149 COC(=O)c1[nH]ccc1Cl 1P003S8J [0,1,0,0,1,0|2,0,0]=4 4308 B10R1.149 COC(=O)c1[nH]ccc1N 1P028PE9 [0,1,0,0,1,0|2,0,0]=4 4309 B10R1.149 COC(=O)c1[nH]ccc1O 1P00G7H9 [0,1,0,0,1,0|1,0,0]=3 4310 B10R1.149 COC(=O)c1c[nH]cc1Br 1P027L5B [0,1,0,0,1,0|2,0,0]=4 4311 B10R1.149 COC(=O)c1c[nH]cc1C 1P00CB72 [0,1,0,0,1,0|2,0,0]=4 4312 B10R1.149 COC(=O)c1cc[nH]c1C 1P00CL8Q [0,1,0,0,1,0|2,0,0]=4 4313 B10R1.149 COC(=O)c1cc[nH]c1Cl 1P01B625 [0,1,0,0,1,0|2,0,0]=4 4314 B10R1.149 COC(=O)c1cccn1C 1P00BYMU [0,1,0,0,1,0|2,0,0]=4 4315 B10R1.149 COC(=O)c1cccn1N 1P0017CT [0,1,0,0,1,0|2,0,0]=4 4316 B10R1.149 COC(=O)c1ccoc1Br 1P002BKR [0,1,0,0,1,0|2,0,0]=4 4317 B10R1.149 COC(=O)c1ccoc1C 1P003S5G [0,1,0,0,1,0|2,0,0]=4 4318 B10R1.149 COC(=O)c1ccoc1I 1P02936F [0,1,0,0,1,0|2,0,0]=4 4319 B10R1.149 COC(=O)c1ccsc1Br 1P008OBJ [0,1,0,0,1,0|2,0,0]=4 4320 B10R1.149 COC(=O)c1ccsc1C 1P00D9FB [0,1,0,0,1,0|2,0,0]=4 4321 B10R1.149 COC(=O)c1ccsc1Cl 1P00ID72 [0,1,0,0,1,0|2,0,0]=4 4322 B10R1.149 COC(=O)c1ccsc1F 1P00GGSC [0,1,0,0,1,0|2,0,0]=4 4323 B10R1.149 COC(=O)c1ccsc1N 1P0035MG [0,1,0,0,1,0|2,0,0]=4 4324 B10R1.149 COC(=O)c1cocc1Br 1P01K7QS [0,1,0,0,1,0|2,0,0]=4 4325 B10R1.149 COC(=O)c1cscc1Br 1P005E56 [0,1,0,0,1,0|2,0,0]=4 4326 B10R1.149 COC(=O)c1cscc1C 1P00F5JT [0,1,0,0,1,0|2,0,0]=4 4327 B10R1.149 COC(=O)c1cscc1F 1P01EIZN [0,1,0,0,1,0|2,0,0]=4 4328 B10R1.149 COC(=O)c1cscc1N 1P0035O0 [0,1,0,0,1,0|2,0,0]=4 4329 B10R1.149 COC(=O)c1cscc1N 1P0060RX [0,1,0,0,1,0|2,0,0]=4 4330 B10R1.149 COC(=O)c1cscc1O 1P01GX5F [0,1,0,0,1,0|1,0,0]=3 4331 B10R1.149 COC(=O)c1occc1Br 1P01C605 [0,1,0,0,1,0|2,0,0]=4 4332 B10R1.149 COC(=O)c1occc1C 1P003S9K [0,1,0,0,1,0|2,0,0]=4 4333 B10R1.149 COC(=O)c1occc1N 1P0022TT [0,1,0,0,1,0|2,0,0]=4 4334 B10R1.149 COC(=O)c1occc1N 1P00H97Y [0,1,0,0,1,0|2,0,0]=4 4335 B10R1.149 COC(=O)c1sccc1Br 1P002SAQ [0,1,0,0,1,0|2,0,0]=4 4336 B10R1.149 COC(=O)c1sccc1C 1P003S9S [0,1,0,0,1,0|2,0,0]=4 4337 B10R1.149 COC(=O)c1sccc1Cl 1P003S8M [0,1,0,0,1,0|2,0,0]=4 4338 B10R1.149 COC(=O)c1sccc1F 1P0002EM [0,1,0,0,1,0|2,0,0]=4 4339 B10R1.149 COC(=O)c1sccc1I 1P00EKSO [0,1,0,0,1,0|2,0,0]=4 4340 B10R1.149 COC(=O)c1sccc1N 1P0035N7 [0,1,0,0,1,0|2,0,0]=4 4341 B10R1.149 COC(=O)c1sccc1O 1P003S97 [0,1,0,0,1,0|1,0,0]=3 4342 B10R1.192 OC(=O)c1c(Br)ccn1C 1P01XCU3 [0,1,0,0,1,0|2,0,0]=4 4343 B10R1.192 OC(=O)c1c(C)c[nH]c1C 1P00385A [0,1,0,0,1,0|2,0,0]=4 4344 B10R1.192 OC(=O)c1c(C)ccn1C 1P00D1KC [0,1,0,0,1,0|2,0,0]=4 4345 B10R1.192 OC(=O)c1c(C)coc1C 1P001N7R [0,1,0,0,1,0|2,0,0]=4 4346 B10R1.192 OC(=O)c1c(C)ncn1O 1P0284I3 [0,1,0,0,1,0|2,0,0]=4 4347 B10R1.192 OC(=O)c1c(C)onc1O 1P01A11S [0,1,0,0,1,0|2,0,0]=4 4348 B10R1.192 OC(=O)c1c(C)scc1Cl 1P0291MR [0,1,0,0,1,0|2,0,0]=4 4349 B10R1.192 OC(=O)c1c(Cl)ccn1C 1P0019XW [0,1,0,0,1,0|2,0,0]=4 4350 B10R1.192 OC(=O)c1c(Cl)csc1Cl 1P01DWKW [0,1,0,0,1,0|2,0,0]=4 4351 B10R1.192 OC(=O)c1c(Cl)scc1C 1P01A51D [0,1,0,0,1,0|2,0,0]=4 4352 B10R1.194 Cn1c(ccc1Br)C(=O)O 1P0036VU [0,1,0,0,1,0|2,0,0]=4 4353 B10R1.194 Cn1c(ccc1C)C(=O)O 1P008RE5 [0,1,0,0,1,0|2,0,0]=4 4354 B10R1.194 OC(=O)c1[nH]cc(c1C)C 1P0036QK [0,1,0,0,1,0|2,0,0]=4 4355 B10R1.194 OC(=O)c1[nH]cc(c1C)I 1P02937L [0,1,0,0,1,0|2,0,0]=4 4356 B10R1.194 OC(=O)c1[nH]cc(c1F)F 1P001SI4 [0,1,0,0,1,0|2,0,0]=4 4357 B10R1.194 OC(=O)c1ccn(c1C)C 1P00IGAB [0,1,0,0,1,0|2,0,0]=4 4358 B10R1.194 OC(=O)c1cnn(c1O)C 1P01A3SG [0,1,0,0,1,0|2,0,0]=4 4359 B10R1.194 OC(=O)c1csc(c1Br)Br 1P00044J [0,1,0,0,1,0|2,0,0]=4 4360 B10R1.194 OC(=O)c1csc(c1Br)C 1P028AOO [0,1,0,0,1,0|2,0,0]=4 4361 B10R1.194 OC(=O)c1csc(c1Br)Cl 1P028O5A [0,1,0,0,1,0|2,0,0]=4 4362 B10R1.194 OC(=O)c1csc(c1Br)I 1P01BSFJ [0,1,0,0,1,0|2,0,0]=4 4363 B10R1.194 OC(=O)c1csc(c1C)Br 1P01ADGG [0,1,0,0,1,0|2,0,0]=4 4364 B10R1.194 OC(=O)c1csc(c1C)C 1P00ADIX [0,1,0,0,1,0|2,0,0]=4 4365 B10R1.194 OC(=O)c1csc(c1Cl)Br 1P01FJ2O [0,1,0,0,1,0|2,0,0]=4 4366 B10R1.194 OC(=O)c1csc(c1Cl)Cl 1P000L0I [0,1,0,0,1,0|2,0,0]=4 4367 B10R1.194 OC(=O)c1csc(c1N)C 1P00FI8P [0,1,0,0,1,0|2,0,0]=4 4368 B10R1.194 OC(=O)c1csc(c1N)C 1P01FIWP [0,1,0,0,1,0|2,0,0]=4 4369 B10R1.194 OC(=O)c1occ(c1C)C 1P01BAI3 [0,1,0,0,1,0|2,0,0]=4 4370 B10R1.194 OC(=O)c1scc(c1Br)Br 1P00FHE7 [0,1,0,0,1,0|2,0,0]=4 4371 B10R1.194 OC(=O)c1scc(c1Br)C 1P01AGSI [0,1,0,0,1,0|2,0,0]=4 4372 B10R1.194 OC(=O)c1scc(c1C)Br 1P002U68 [0,1,0,0,1,0|2,0,0]=4 4373 B10R1.194 OC(=O)c1scc(c1C)C 1P003WK4 [0,1,0,0,1,0|2,0,0]=4 4374 B10R1.194 OC(=O)c1scc(c1C)N 1P027VXQ [0,1,0,0,1,0|2,0,0]=4 4375 B10R1.194 OC(=O)c1scc(c1Cl)Br 1P027NBW [0,1,0,0,1,0|2,0,0]=4 4376 B10R1.194 OC(=O)c1scc(c1Cl)C 1P002M18 [0,1,0,0,1,0|2,0,0]=4 4377 B10R1.194 OC(=O)c1scc(c1Cl)Cl 1P01DWZU [0,1,0,0,1,0|2,0,0]=4 4378 B10R1.194 OC(=O)c1scc(c1F)F 1P0290KP [0,1,0,0,1,0|2,0,0]=4 4379 B10R1.194 OC(=O)c1scc(c1I)C 1P00GFOT [0,1,0,0,1,0|2,0,0]=4 4380 B10R1.194 OC(=O)c1scc(c1N)Br 1P01U8TH [0,1,0,0,1,0|2,0,0]=4 4381 B12R1.75 BrCc1ccccc1CC(=O)C 1P01C8VJ [0,1,0,0,0,1|2,0,0]=4 4382 B12R1.75 BrCc1ccccc1CC(=O)O 1P0013NJ [0,1,0,0,0,1|1,0,0]=3 4383 B12R1.75 BrCc1ccccc1OC(=O)C 1P00FD02 [0,1,0,0,0,1|2,0,0]=4 4384 B12R1.75 C#Cc1ccccc1CC(=O)N 1P01EN8O [0,1,0,0,0,1|2,0,0]=4 4385 B12R1.75 C#Cc1ccccc1NC(=O)C 1P01CAC7 [0,1,0,0,0,1|2,0,0]=4 4386 B12R1.75 C=Cc1ccccc1OC(=O)C 1P003O3B [0,1,0,0,0,1|2,0,0]=4 4387 B12R1.75 CCc1ccccc1CC(=O)O 1P01B1QZ [0,1,0,0,0,1|1,0,0]=3 4388 B12R1.75 CCc1ccccc1OC(=O)C 1P00310J [0,1,0,0,0,1|2,0,0]=4 4389 B12R1.75 COc1ccccc1CC(=O)Cl 1P00BDPD [0,1,0,0,0,1|1,0,0]=3 4390 B12R1.75 COc1ccccc1CC(=O)N 1P00C6TR [0,1,0,0,0,1|1,0,0]=3 4391 B12R1.75 COc1ccccc1CC(=O)O 1P003I14 [0,1,0,0,0,1|0,0,0]=2 4392 B12R1.75 COc1ccccc1CC(O)C 1P001ODG [0,1,0,0,0,1|1,0,1]=4 4393 B12R1.75 COc1ccccc1C[C@@H](O)C 1P019RP5 [0,1,0,0,0,1|1,0,1]=4 4394 B12R1.75 COc1ccccc1C[C@H](O)C 1P019RP6 [0,1,0,0,0,1|1,0,1]=4 4395 B12R1.75 COc1ccccc1NC(=O)C 1P003TW2 [0,1,0,0,0,1|1,0,0]=3 4396 B12R1.75 COc1ccccc1NC(=S)N 1P001NWC [0,1,0,0,0,1|1,1,0]=4 4397 B12R1.75 COc1ccccc1OC(=O)C 1P007K8N [0,1,0,0,0,1|1,0,0]=3 4398 B12R1.75 COc1ccccc1OC(=O)Cl 1P002M07 [0,1,0,0,0,1|1,0,0]=3 4399 B12R1.75 COc1cccnc1CC(=O)O 1P01BH08 [0,1,0,0,0,1|1,0,0]=3 4400 B12R1.75 COc1cccnc1CC(=O)[O-] 1P001V8R [0,1,0,0,0,1|1,0,1]=4 4401 B12R1.75 COc1ncccc1CC(=O)O 1P00BXXI [0,1,0,0,0,1|1,0,0]=3 4402 B12R1.75 CSc1ccccc1CC(=O)C 1P01A6PH [0,1,0,0,0,1|1,1,0]=4 4403 B12R1.75 CSc1ccccc1CC(=O)O 1P007YVE [0,1,0,0,0,1|0,1,0]=3 4404 B12R1.75 CSc1ccccc1NC(=O)C 1P00ECV1 [0,1,0,0,0,1|1,1,0]=4 4405 B12R1.75 CSc1ccccc1OC(=O)C 1P028MS5 [0,1,0,0,0,1|1,1,0]=4 4406 B12R1.75 ClCc1ccccc1CC(=O)O 1P003AF9 [0,1,0,0,0,1|1,0,0]=3 4407 B12R1.75 ClCc1ccccc1NC(=O)C 1P01EMA2 [0,1,0,0,0,1|2,0,0]=4 4408 B12R1.75 N#Cc1ccccc1CC(=O)O 1P0039DC [0,1,0,0,0,1|1,0,0]=3 4409 B12R1.75 N#Cc1ccccc1NC(=O)C 1P00C522 [0,1,0,0,0,1|2,0,0]=4 4410 B12R1.75 N#Cc1ccccc1NC(=O)N 1P00E5Y5 [0,1,0,0,0,1|2,0,0]=4 4411 B12R1.75 N#Cc1ccccc1OC(=O)C 1P003GRC [0,1,0,0,0,1|2,0,0]=4 4412 B12R1.75 NCc1ccccc1CC(=O)O 1P0033KY [0,1,0,0,0,1|1,0,0]=3 4413 B12R1.75 NCc1ccccc1NC(=O)C 1P019Q8P [0,1,0,0,0,1|2,0,0]=4 4414 B12R1.75 O=Cc1ccccc1CC(=O)O 1P00ABZG [0,1,0,0,0,1|0,0,1]=3 4415 B12R1.75 O=Cc1ccccc1NC(=O)C 1P0070B5 [0,1,0,0,0,1|1,0,1]=4 4416 B12R1.75 O=Cc1ccccc1OC(=O)C 1P00ELLC [0,1,0,0,0,1|1,0,1]=4 4417 B12R1.75 OCc1ccccc1CC(=O)[O-] 1P01AGG9 [0,1,0,0,0,1|0,0,1]=3 4418 B12R1.75 OCc1ccccc1NC(=O)C 1P002KO2 [0,1,0,0,0,1|1,0,0]=3 4419 B12R1.75 SCc1ccccc1CC(=O)O 1P01BBX3 [0,1,0,0,0,1|0,1,0]=3 4420 B12R1.124 CC(=O)C(c1ccccc1Br)Br 1P0292SH [0,1,0,0,0,1|2,0,0]=4 4421 B12R1.124 CC(=O)N(c1ccccc1N)C 1P00CCJE [0,1,0,0,0,1|2,0,0]=4 4422 B12R1.124 ClC(=O)N(c1ccccc1Cl)C 1P028ARK [0,1,0,0,0,1|2,0,0]=4 4423 B12R1.124 NC(=O)C(c1ccccc1F)N 1P01AE8U [0,1,0,0,0,1|2,0,0]=4 4424 B12R1.124 NC(=O)C(c1ccccc1F)N 1P01AJXQ [0,1,0,0,0,1|2,0,0]=4 4425 B12R1.124 O=C(O)C(F)C1=CC=CC=C1F 1P01K6C1 [0,1,0,0,0,1|1,0,0]=3 4426 B12R1.124 OC(=O)C(=O)c1ccccc1Br 1P00C2CO [0,1,0,0,0,1|1,0,0]=3 4427 B12R1.124 OC(=O)C(=O)c1ccccc1C 1P01JML1 [0,1,0,0,0,1|1,0,0]=3 4428 B12R1.124 OC(=O)C(=O)c1ccccc1Cl 1P002S7X [0,1,0,0,0,1|1,0,0]=3 4429 B12R1.124 OC(=O)C(=O)c1ccccc1F 1P0052A8 [0,1,0,0,0,1|1,0,0]=3 4430 B12R1.124 OC(=O)C(=O)c1ccccc1O 1P028KJP [0,1,0,0,0,1|0,0,0]=2 4431 B12R1.124 OC(=O)C(c1ccccc1Br)Br 1P01JWMC [0,1,0,0,0,1|1,0,0]=3 4432 B12R1.124 OC(=O)C(c1ccccc1Br)C 1P00AOE4 [0,1,0,0,0,1|1,0,0]=3 4433 B12R1.124 OC(=O)C(c1ccccc1Br)F 1P00GSVC [0,1,0,0,0,1|1,0,0]=3 4434 B12R1.124 OC(=O)C(c1ccccc1Br)N 1P00BD3T [0,1,0,0,0,1|1,0,0]=3 4435 B12R1.124 OC(=O)C(c1ccccc1Br)O 1P005H7Z [0,1,0,0,0,1|1,0,0]=3 4436 B12R1.124 OC(=O)C(c1ccccc1C)C 1P01A6R5 [0,1,0,0,0,1|1,0,0]=3 4437 B12R1.124 OC(=O)C(c1ccccc1C)F 1P01NLK6 [0,1,0,0,0,1|1,0,0]=3 4438 B12R1.124 OC(=O)C(c1ccccc1C)N 1P000ZP4 [0,1,0,0,0,1|1,0,0]=3 4439 B12R1.124 OC(=O)C(c1ccccc1C)N 1P00IFAT [0,1,0,0,0,1|1,0,0]=3 4440 B12R1.124 OC(=O)C(c1ccccc1Cl)Br 1P001GE9 [0,1,0,0,0,1|1,0,0]=3 4441 B12R1.124 OC(=O)C(c1ccccc1Cl)C 1P007PJ7 [0,1,0,0,0,1|1,0,0]=3 4442 B12R1.124 OC(=O)C(c1ccccc1Cl)Cl 1P028AEP [0,1,0,0,0,1|1,0,0]=3 4443 B12R1.124 OC(=O)C(c1ccccc1Cl)F 1P01KXH4 [0,1,0,0,0,1|1,0,0]=3 4444 B12R1.124 OC(=O)C(c1ccccc1Cl)N 1P003B40 [0,1,0,0,0,1|1,0,0]=3 4445 B12R1.124 OC(=O)C(c1ccccc1Cl)O 1P003HJ9 [0,1,0,0,0,1|1,0,0]=3 4446 B12R1.124 OC(=O)C(c1ccccc1F)C 1P00FH6T [0,1,0,0,0,1|1,0,0]=3 4447 B12R1.124 OC(=O)C(c1ccccc1F)Cl 1P028530 [0,1,0,0,0,1|1,0,0]=3 4448 B12R1.124 OC(=O)C(c1ccccc1F)N 1P002NNL [0,1,0,0,0,1|1,0,0]=3 4449 B12R1.124 OC(=O)C(c1ccccc1F)N 1P00ICKY [0,1,0,0,0,1|1,0,0]=3 4450 B12R1.124 OC(=O)C(c1ccccc1F)O 1P003HSM [0,1,0,0,0,1|1,0,0]=3 4451 B12R1.124 OC(=O)C(c1ccccc1I)F 1P0293A8 [0,1,0,0,0,1|1,0,0]=3 4452 B12R1.124 OC(=O)C(c1ccccc1I)N 1P01ELXB [0,1,0,0,0,1|1,0,0]=3 4453 B12R1.124 OC(=O)C(c1ccccc1I)O 1P01DT8K [0,1,0,0,0,1|1,0,0]=3 4454 B12R1.124 OC(=O)C(c1ccccc1O)N 1P002R85 [0,1,0,0,0,1|0,0,0]=2 4455 B12R1.124 OC(=O)C(c1ccncc1C)C 1P028LC0 [0,1,0,0,0,1|2,0,0]=4 4456 B12R1.124 OC(=O)C(c1ncccc1C)O 1P01BGPB [0,1,0,0,0,1|2,0,0]=4 4457 B12R1.124 OC(=O)C(n1ccccc1=O)C 1P01DISN [0,1,0,0,0,1|1,0,1]=4 4458 B12R1.124 OC(=O)[C@@H](c1ccccc1C)N 1P01KL0M [0,1,0,0,0,1|1,0,0]=3 4459 B12R1.124 OC(=O)[C@@H](c1ccccc1Cl)N 1P008FMJ [0,1,0,0,0,1|1,0,0]=3 4460 B12R1.124 OC(=O)[C@@H](c1ccccc1Cl)O 1P003CJE [0,1,0,0,0,1|1,0,0]=3 4461 B12R1.124 OC(=O)[C@@H](c1ccccc1F)N 1P01KKG9 [0,1,0,0,0,1|1,0,0]=3 4462 B12R1.124 OC(=O)[C@@H](c1ccccc1F)O 1P00BXTS [0,1,0,0,0,1|1,0,0]=3 4463 B12R1.124 OC(=O)[C@@H](c1ccccc1O)N 1P024G33 [0,1,0,0,0,1|0,0,0]=2 4464 B12R1.124 OC(=O)[C@H](c1ccccc1Br)N 1P000WEC [0,1,0,0,0,1|1,0,0]=3 4465 B12R1.124 OC(=O)[C@H](c1ccccc1C)N 1P023PAX [0,1,0,0,0,1|1,0,0]=3 4466 B12R1.124 OC(=O)[C@H](c1ccccc1Cl)N 1P001GND [0,1,0,0,0,1|1,0,0]=3 4467 B12R1.124 OC(=O)[C@H](c1ccccc1Cl)O 1P003CX7 [0,1,0,0,0,1|1,0,0]=3 4468 B12R1.124 OC(=O)[C@H](c1ccccc1F)N 1P0201ZK [0,1,0,0,0,1|1,0,0]=3 4469 B12R1.124 OC(=O)[C@H](c1ccccc1F)O 1P0020LV [0,1,0,0,0,1|1,0,0]=3 4470 B12R1.124 OC(=O)[C@H](c1ccccc1O)N 1P024G2K [0,1,0,0,0,1|0,0,0]=2 4471 B12R1.124 [O-]C(=O)C(=O)c1ccccc1N 1P0024X4 [0,1,0,0,0,1|1,0,1]=4 4472 B12R1.127 CC(=O)Cc1cc(F)ccc1Br 1P01AIMK [0,1,0,0,0,1|2,0,0]=4 4473 B12R1.127 CC(=O)Cc1cc(F)ccc1F 1P01EROX [0,1,0,0,0,1|2,0,0]=4 4474 B12R1.127 CC(=O)Nc1cc(Br)ccc1Br 1P00BJ57 [0,1,0,0,0,1|2,0,0]=4 4475 B12R1.127 CC(=O)Nc1cc(C)ccc1Br 1P000TNP [0,1,0,0,0,1|2,0,0]=4 4476 B12R1.127 CC(=O)Nc1cc(C)ccc1C 1P002A9U [0,1,0,0,0,1|2,0,0]=4 4477 B12R1.127 CC(=O)Nc1cc(C)ccc1Cl 1P01BBLF [0,1,0,0,0,1|2,0,0]=4 4478 B12R1.127 CC(=O)Nc1cc(C)ccc1O 1P00IBQ9 [0,1,0,0,0,1|1,0,0]=3 4479 B12R1.127 CC(=O)Nc1cc(Cl)ccc1Cl 1P002SQY [0,1,0,0,0,1|2,0,0]=4 4480 B12R1.127 CC(=O)Nc1cc(Cl)ccc1N 1P01A9IB [0,1,0,0,0,1|2,0,0]=4 4481 B12R1.127 CC(=O)Nc1cc(Cl)ccc1O 1P002TVM [0,1,0,0,0,1|1,0,0]=3 4482 B12R1.127 CC(=O)Nc1cc(F)ccc1Br 1P024HZ8 [0,1,0,0,0,1|2,0,0]=4 4483 B12R1.127 CC(=O)Nc1cc(F)ccc1F 1P00CBBL [0,1,0,0,0,1|2,0,0]=4 4484 B12R1.127 CC(=O)Nc1cc(F)ccc1I 1P000EMP [0,1,0,0,0,1|2,0,0]=4 4485 B12R1.127 CC(=O)Nc1cc(N)ccc1Cl 1P00EETD [0,1,0,0,0,1|2,0,0]=4 4486 B12R1.127 CC(=O)Nc1cc(N)ccc1F 1P00G53P [0,1,0,0,0,1|2,0,0]=4 4487 B12R1.127 CC(=O)Nc1cc(N)ccc1O 1P002MXE [0,1,0,0,0,1|1,0,0]=3 4488 B12R1.127 CC(=O)Nc1cc(O)ccc1Cl 1P00A23V [0,1,0,0,0,1|2,0,0]=4 4489 B12R1.127 CC(=O)Nc1cc(O)ccc1O 1P01XDDE [0,1,0,0,0,1|1,0,0]=3 4490 B12R1.127 Cc1cc(CC(=O)O)c(cc1)Br 1P0029AO [0,1,0,0,0,1|1,0,0]=3 4491 B12R1.127 Cc1cc(CC(=O)O)c(cc1)Cl 1P00IDO0 [0,1,0,0,0,1|1,0,0]=3 4492 B12R1.127 Cc1cc(CC(=O)O)c(cc1)F 1P00299O [0,1,0,0,0,1|1,0,0]=3 4493 B12R1.127 Cc1cc(CC(=O)O)c(cc1)O 1P028MBW [0,1,0,0,0,1|0,0,0]=2 4494 B12R1.127 Cc1ccc(cc1CC(=O)Cl)C 1P00DE01 [0,1,0,0,0,1|2,0,0]=4 4495 B12R1.127 Cc1ccc(cc1CC(=O)O)Br 1P0039XU [0,1,0,0,0,1|1,0,0]=3 4496 B12R1.127 Cc1ccc(cc1CC(=O)O)C 1P003GGS [0,1,0,0,0,1|1,0,0]=3 4497 B12R1.127 Cc1ccc(cc1CC(=O)O)Cl 1P027VT5 [0,1,0,0,0,1|1,0,0]=3 4498 B12R1.127 Cc1ccc(cc1CC(=O)O)F 1P002SNB [0,1,0,0,0,1|1,0,0]=3 4499 B12R1.127 Cc1ccc(cc1CC(=O)O)I 1P028A87 [0,1,0,0,0,1|1,0,0]=3 4500 B12R1.127 Cc1ccc(cc1NC(=O)C)Br 1P000CYH [0,1,0,0,0,1|2,0,0]=4 4501 B12R1.127 Cc1ccc(cc1NC(=O)C)F 1P00CLHR [0,1,0,0,0,1|2,0,0]=4 4502 B12R1.127 Cc1ccc(cc1NC(=O)C)N 1P00DCZN [0,1,0,0,0,1|2,0,0]=4 4503 B12R1.127 Cc1ccc(cc1NC(=O)N)C 1P01C7OG [0,1,0,0,0,1|2,0,0]=4 4504 B12R1.127 Cc1ccc(cc1OC(=O)C)Br 1P028OYV [0,1,0,0,0,1|2,0,0]=4 4505 B12R1.127 Cc1cn(CC(=O)O)c(=O)cc1 1P0284AN [0,1,0,0,0,1|1,0,1]=4 4506 B12R1.127 Cc1ncc(cc1CC(=O)O)Cl 1P028G4B [0,1,0,0,0,1|2,0,0]=4 4507 B12R1.127 ClC(=O)Cc1cc(Cl)ccc1Cl 1P0029AM [0,1,0,0,0,1|2,0,0]=4 4508 B12R1.127 Fc1ccc(cc1CC(=O)Cl)F 1P00ABJI [0,1,0,0,0,1|2,0,0]=4 4509 B12R1.127 NC(=O)Nc1cc(Cl)ccc1O 1P00EFZW [0,1,0,0,0,1|1,0,0]=3 4510 B12R1.127 NC(=O)Nc1cc(N)ccc1F 1P01ALSY [0,1,0,0,0,1|2,0,0]=4 4511 B12R1.127 Nc1cc(CC(=O)O)c(cc1)F 1P00DNW2 [0,1,0,0,0,1|1,0,0]=3 4512 B12R1.127 Nc1ccc(cc1CC(=O)O)Br 1P00ICWI [0,1,0,0,0,1|1,0,0]=3 4513 B12R1.127 Nc1ccc(cc1CC(=O)O)F 1P01KLLI [0,1,0,0,0,1|1,0,0]=3 4514 B12R1.127 OC(=O)Cc1cc(Br)ccc1Br 1P0029AP [0,1,0,0,0,1|1,0,0]=3 4515 B12R1.127 OC(=O)Cc1cc(Br)ccc1Cl 1P00265R [0,1,0,0,0,1|1,0,0]=3 4516 B12R1.127 OC(=O)Cc1cc(Br)ccc1F 1P003MXR [0,1,0,0,0,1|1,0,0]=3 4517 B12R1.127 OC(=O)Cc1cc(Br)ccc1I 1P00IMH6 [0,1,0,0,0,1|1,0,0]=3 4518 B12R1.127 OC(=O)Cc1cc(Br)cnc1F 1P021UWC [0,1,0,0,0,1|2,0,0]=4 4519 B12R1.127 OC(=O)Cc1cc(Cl)ccc1Br 1P0033M8 [0,1,0,0,0,1|1,0,0]=3 4520 B12R1.127 OC(=O)Cc1cc(Cl)ccc1Cl 1P00DFVY [0,1,0,0,0,1|1,0,0]=3 4521 B12R1.127 OC(=O)Cc1cc(Cl)ccc1F 1P002SIJ [0,1,0,0,0,1|1,0,0]=3 4522 B12R1.127 OC(=O)Cc1cc(F)ccc1Br 1P003H6G [0,1,0,0,0,1|1,0,0]=3 4523 B12R1.127 OC(=O)Cc1cc(F)ccc1Cl 1P00265S [0,1,0,0,0,1|1,0,0]=3 4524 B12R1.127 OC(=O)Cc1cc(F)ccc1F 1P0033GZ [0,1,0,0,0,1|1,0,0]=3 4525 B12R1.127 OC(=O)Cc1cc(F)ncc1Br 1P028YFC [0,1,0,0,0,1|2,0,0]=4 4526 B12R1.127 OC(=O)Cc1cc(I)ccc1Br 1P000SEY [0,1,0,0,0,1|1,0,0]=3 4527 B12R1.127 OC(=O)Cc1cc(I)ccc1F 1P027XGD [0,1,0,0,0,1|1,0,0]=3 4528 B12R1.127 OC(=O)Cc1cc(O)ccc1Br 1P0288AC [0,1,0,0,0,1|1,0,0]=3 4529 B12R1.127 OC(=O)Cc1cc(O)ccc1F 1P001LTA [0,1,0,0,0,1|1,0,0]=3 4530 B12R1.127 OC(=O)Cc1cc(O)ccc1O 1P003RER [0,1,0,0,0,1|0,0,0]=2 4531 B12R1.127 OC(=O)Cn1cc(Br)ccc1=O 1P00H3M0 [0,1,0,0,0,1|1,0,1]=4 4532 B12R1.127 OC(=O)Cn1cc(F)ccc1=O 1P028D8R [0,1,0,0,0,1|1,0,1]=4 4533 B12R1.127 OC(=O)Cn1cc(I)ccc1=O 1P028ALS [0,1,0,0,0,1|1,0,1]=4 4534 B12R1.127 Oc1ccc(cc1CC(=O)O)Br 1P00CJAH [0,1,0,0,0,1|0,0,0]=2 4535 B12R1.127 Oc1ccc(cc1CC(=O)O)Cl 1P00BKCM [0,1,0,0,0,1|0,0,0]=2 4536 B12R1.151 Oc1ccccc1CS(=O)(=O)C 1P00I9ZX [0,1,0,0,0,1|1,0,1]=4 4537 B12R1.151 Oc1ccccc1CS(=O)(=O)N 1P028ZW9 [0,1,0,0,0,1|1,0,1]=4 4538 B12R1.151 Oc1ccccc1N=S(=O)(C)C 1P01BVZ2 [0,1,0,0,0,1|2,0,0]=4 4539 B12R1.151 Oc1ccccc1NS(=O)(=O)C 1P00FBOG [0,1,0,0,0,1|1,0,1]=4 4540 B12R1.151 Oc1ccccc1OS(=O)(=O)[O-] 1P01X7Z7 [0,1,0,0,0,1|1,0,1]=4 4541 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1P023RXF [0,1,0,0,0,1|2,0,0]=4 4542 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1P0006WM [0,1,0,0,0,1|2,0,0]=4 4543 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1P00EM4Z [0,1,0,0,0,1|2,0,0]=4 4544 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1P00CCKQ [0,1,0,0,0,1|2,0,0]=4 4545 B12R1.224 Cc1c(CC(=O)O)cccc1Br 1P000SCV [0,1,0,0,0,1|1,0,0]=3 4546 B12R1.224 Cc1c(CC(=O)O)cccc1C 1P0032AZ [0,1,0,0,0,1|1,0,0]=3 4547 B12R1.224 Cc1c(CC(=O)O)cccc1Cl 1P024Y4U [0,1,0,0,0,1|1,0,0]=3 4548 B12R1.224 Cc1c(CC(=O)O)cccc1F 1P006WGP [0,1,0,0,0,1|1,0,0]=3 4549 B12R1.224 Cc1c(CC(=O)O)cccc1I 1P000SAS [0,1,0,0,0,1|1,0,0]=3 4550 B12R1.224 Cc1c(CC(=O)O)cccc1N 1P00BJYE [0,1,0,0,0,1|1,0,0]=3 4551 B12R1.224 Cc1c(NC(=O)C)cccc1N 1P00FCWI [0,1,0,0,0,1|2,0,0]=4 4552 B12R1.224 Cc1c(NC(=O)N)cccc1C 1P00AJIJ [0,1,0,0,0,1|2,0,0]=4 4553 B12R1.224 Cc1cccc(c1Br)CC(=O)N 1P01XCHG [0,1,0,0,0,1|2,0,0]=4 4554 B12R1.224 Cc1cccc(c1Br)CC(=O)O 1P002Q81 [0,1,0,0,0,1|1,0,0]=3 4555 B12R1.224 Cc1cccc(c1Cl)CC(=O)O 1P01BE7F [0,1,0,0,0,1|1,0,0]=3 4556 B12R1.224 Cc1cccc(c1F)CC(=O)O 1P01KCN5 [0,1,0,0,0,1|1,0,0]=3 4557 B12R1.224 Cc1cccc(c1I)CC(=O)O 1P0292DT [0,1,0,0,0,1|1,0,0]=3 4558 B12R1.224 Cc1cccc(c1N)CC(=O)O 1P00A0IY [0,1,0,0,0,1|1,0,0]=3 4559 B12R1.224 Cc1cccc(c1O)CC(=O)O 1P01OTH1 [0,1,0,0,0,1|0,0,0]=2 4560 B12R1.224 Cc1cccn(c1=O)CC(=O)O 1P00VU18 [0,1,0,0,0,1|1,0,1]=4 4561 B12R1.224 Nc1c(CC(=O)O)cccc1Br 1P000SIH [0,1,0,0,0,1|1,0,0]=3 4562 B12R1.224 Nc1c(CC(=O)O)cccc1N 1P01BD73 [0,1,0,0,0,1|1,0,0]=3 4563 B12R1.224 Nc1cccn(c1=O)CC(=O)O 1P01A315 [0,1,0,0,0,1|1,0,1]=4 4564 B12R1.224 OC(=O)Cc1cccc(c1Br)Cl 1P000SHC [0,1,0,0,0,1|1,0,0]=3 4565 B12R1.224 OC(=O)Cc1cccc(c1Br)F 1P005XGS [0,1,0,0,0,1|1,0,0]=3 4566 B12R1.224 OC(=O)Cc1cccc(c1Cl)Br 1P000S74 [0,1,0,0,0,1|1,0,0]=3 4567 B12R1.224 OC(=O)Cc1cccc(c1Cl)Cl 1P0007PV [0,1,0,0,0,1|1,0,0]=3 4568 B12R1.224 OC(=O)Cc1cccc(c1Cl)F 1P00015H [0,1,0,0,0,1|1,0,0]=3 4569 B12R1.224 OC(=O)Cc1cccc(c1F)Br 1P001428 [0,1,0,0,0,1|1,0,0]=3 4570 B12R1.224 OC(=O)Cc1cccc(c1F)Cl 1P002SIK [0,1,0,0,0,1|1,0,0]=3 4571 B12R1.224 OC(=O)Cc1cccc(c1F)F 1P001DRS [0,1,0,0,0,1|1,0,0]=3 4572 B12R1.224 OC(=O)Cc1cccc(c1F)O 1P01ACQW [0,1,0,0,0,1|1,0,0]=3 4573 B12R1.224 OC(=O)Cc1cccc(c1I)Br 1P028148 [0,1,0,0,0,1|1,0,0]=3 4574 B12R1.224 OC(=O)Cc1cccc(c1O)O 1P00C2W0 [0,1,0,0,0,1|0,0,0]=2 4575 B12R1.224 OC(=O)Cc1ccnc(c1F)Cl 1P028SCT [0,1,0,0,0,1|2,0,0]=4 4576 B12R1.224 OC(=O)Cc1ccnc(c1F)F 1P01OR6U [0,1,0,0,0,1|2,0,0]=4 4577 B12R1.224 OC(=O)Cn1cccc(c1=O)O 1P01S7MK [0,1,0,0,0,1|1,0,1]=4 4578 B12R1.224 Oc1c(CC(=O)O)cccc1Br 1P024911 [0,1,0,0,0,1|0,0,0]=2 4579 B12R1.224 Oc1c(CC(=O)O)cccc1Cl 1P024UL9 [0,1,0,0,0,1|0,0,0]=2 4580 B12R1.224 Oc1c(CC(=O)O)cccc1F 1P01BIJU [0,1,0,0,0,1|0,0,0]=2 4581 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1P01AIPZ [0,1,0,0,0,1|2,0,0]=4 4582 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1P003G88 [0,1,0,0,0,1|2,0,0]=4 4583 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1P00GNXK [0,1,0,0,0,1|2,0,0]=4 4584 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1P01AHAO [0,1,0,0,0,1|2,0,0]=4 4585 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1P01DVOG [0,1,0,0,0,1|2,0,0]=4 4586 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1P00BDJ5 [0,1,0,0,0,1|2,0,0]=4 4587 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 1P003H57 [0,1,0,0,0,1|2,0,0]=4 4588 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1P00EC45 [0,1,0,0,0,1|2,0,0]=4 4589 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 1P0003LJ [0,1,0,0,0,1|2,0,0]=4 4590 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 1P003LDU [0,1,0,0,0,1|2,0,0]=4 4591 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1P002A9V [0,1,0,0,0,1|2,0,0]=4 4592 B12R1.233 CC(=O)Nc1ccc(cc1C)F 1P00BZ68 [0,1,0,0,0,1|2,0,0]=4 4593 B12R1.233 CC(=O)Nc1ccc(cc1C)N 1P00EAK3 [0,1,0,0,0,1|2,0,0]=4 4594 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 1P003LCV [0,1,0,0,0,1|2,0,0]=4 4595 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1P003G7M [0,1,0,0,0,1|2,0,0]=4 4596 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 1P003BNN [0,1,0,0,0,1|2,0,0]=4 4597 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 1P008077 [0,1,0,0,0,1|2,0,0]=4 4598 B12R1.233 CC(=O)Nc1ccc(cc1Cl)N 1P003T46 [0,1,0,0,0,1|2,0,0]=4 4599 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 1P003LDD [0,1,0,0,0,1|2,0,0]=4 4600 B12R1.233 CC(=O)Nc1ccc(cc1F)C 1P01BGG6 [0,1,0,0,0,1|2,0,0]=4 4601 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1P003LJP [0,1,0,0,0,1|2,0,0]=4 4602 B12R1.233 CC(=O)Nc1ccc(cc1F)F 1P003G90 [0,1,0,0,0,1|2,0,0]=4 4603 B12R1.233 CC(=O)Nc1ccc(cc1F)O 1P021KAI [0,1,0,0,0,1|2,0,0]=4 4604 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 1P00DGPG [0,1,0,0,0,1|2,0,0]=4 4605 B12R1.233 CC(=O)Nc1ccc(cc1N)Br 1P00J7LY [0,1,0,0,0,1|2,0,0]=4 4606 B12R1.233 CC(=O)Nc1ccc(cc1N)C 1P00DD4L [0,1,0,0,0,1|2,0,0]=4 4607 B12R1.233 CC(=O)Nc1ccc(cc1N)Cl 1P00DDLR [0,1,0,0,0,1|2,0,0]=4 4608 B12R1.233 CC(=O)Nc1ccc(cc1O)C 1P009EB6 [0,1,0,0,0,1|1,0,0]=3 4609 B12R1.233 CC(=O)Oc1ccc(cc1Br)Cl 1P00IKJR [0,1,0,0,0,1|2,0,0]=4 4610 B12R1.233 CC(=O)Oc1ccc(cc1C)Br 1P01AFPG [0,1,0,0,0,1|2,0,0]=4 4611 B12R1.233 CC(=O)Oc1ccc(cc1Cl)Br 1P01BIUD [0,1,0,0,0,1|2,0,0]=4 4612 B12R1.233 CC(=O)Oc1ccc(cc1Cl)Cl 1P00EB3F [0,1,0,0,0,1|2,0,0]=4 4613 B12R1.233 ClC(=O)Oc1ccc(cc1C)F 1P01BHX6 [0,1,0,0,0,1|2,0,0]=4 4614 B12R1.233 ClC(=O)Oc1ccc(cc1F)Br 1P01ACSO [0,1,0,0,0,1|2,0,0]=4 4615 B12R1.233 ClC(=O)Oc1ccc(cc1F)F 1P01B8ML [0,1,0,0,0,1|2,0,0]=4 4616 B12R1.233 NC(=O)Cc1ccc(cc1C)Br 1P01C8KF [0,1,0,0,0,1|2,0,0]=4 4617 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl 1P01KL86 [0,1,0,0,0,1|2,0,0]=4 4618 B12R1.233 NC(=O)Cc1ccc(cc1F)F 1P01B9TF [0,1,0,0,0,1|2,0,0]=4 4619 B12R1.233 NC(=O)Nc1ccc(cc1C)C 1P003GBD [0,1,0,0,0,1|2,0,0]=4 4620 B12R1.233 OC(=O)Cc1ccc(cc1Br)Br 1P00IKJT [0,1,0,0,0,1|1,0,0]=3 4621 B12R1.233 OC(=O)Cc1ccc(cc1Br)C 1P01C1S1 [0,1,0,0,0,1|1,0,0]=3 4622 B12R1.233 OC(=O)Cc1ccc(cc1Br)Cl 1P00DEPF [0,1,0,0,0,1|1,0,0]=3 4623 B12R1.233 OC(=O)Cc1ccc(cc1Br)F 1P003H50 [0,1,0,0,0,1|1,0,0]=3 4624 B12R1.233 OC(=O)Cc1ccc(cc1Br)O 1P004AF7 [0,1,0,0,0,1|1,0,0]=3 4625 B12R1.233 OC(=O)Cc1ccc(cc1C)Br 1P00IE42 [0,1,0,0,0,1|1,0,0]=3 4626 B12R1.233 OC(=O)Cc1ccc(cc1C)C 1P003GBA [0,1,0,0,0,1|1,0,0]=3 4627 B12R1.233 OC(=O)Cc1ccc(cc1C)Cl 1P01A4I7 [0,1,0,0,0,1|1,0,0]=3 4628 B12R1.233 OC(=O)Cc1ccc(cc1C)F 1P003LU3 [0,1,0,0,0,1|1,0,0]=3 4629 B12R1.233 OC(=O)Cc1ccc(cc1C)N 1P00I7CP [0,1,0,0,0,1|1,0,0]=3 4630 B12R1.233 OC(=O)Cc1ccc(cc1C)O 1P00BKCL [0,1,0,0,0,1|1,0,0]=3 4631 B12R1.233 OC(=O)Cc1ccc(cc1Cl)Br 1P00390E [0,1,0,0,0,1|1,0,0]=3 4632 B12R1.233 OC(=O)Cc1ccc(cc1Cl)C 1P01A0L2 [0,1,0,0,0,1|1,0,0]=3 4633 B12R1.233 OC(=O)Cc1ccc(cc1Cl)Cl 1P002B4A [0,1,0,0,0,1|1,0,0]=3 4634 B12R1.233 OC(=O)Cc1ccc(cc1Cl)F 1P00265T [0,1,0,0,0,1|1,0,0]=3 4635 B12R1.233 OC(=O)Cc1ccc(cc1Cl)N 1P01KLD4 [0,1,0,0,0,1|1,0,0]=3 4636 B12R1.233 OC(=O)Cc1ccc(cc1Cl)O 1P01A0FB [0,1,0,0,0,1|1,0,0]=3 4637 B12R1.233 OC(=O)Cc1ccc(cc1F)Br 1P000FUW [0,1,0,0,0,1|1,0,0]=3 4638 B12R1.233 OC(=O)Cc1ccc(cc1F)C 1P003BOP [0,1,0,0,0,1|1,0,0]=3 4639 B12R1.233 OC(=O)Cc1ccc(cc1F)Cl 1P003LJY [0,1,0,0,0,1|1,0,0]=3 4640 B12R1.233 OC(=O)Cc1ccc(cc1F)F 1P0032PX [0,1,0,0,0,1|1,0,0]=3 4641 B12R1.233 OC(=O)Cc1ccc(cc1F)N 1P00GS6Z [0,1,0,0,0,1|1,0,0]=3 4642 B12R1.233 OC(=O)Cc1ccc(cc1F)O 1P005O4M [0,1,0,0,0,1|1,0,0]=3 4643 B12R1.233 OC(=O)Cc1ccc(cc1I)Br 1P01FQJ6 [0,1,0,0,0,1|1,0,0]=3 4644 B12R1.233 OC(=O)Cc1ccc(cc1I)Cl 1P01JYXV [0,1,0,0,0,1|1,0,0]=3 4645 B12R1.233 OC(=O)Cc1ccc(cc1I)F 1P027Y1Y [0,1,0,0,0,1|1,0,0]=3 4646 B12R1.233 OC(=O)Cc1ccc(cc1N)Br 1P000SES [0,1,0,0,0,1|1,0,0]=3 4647 B12R1.233 OC(=O)Cc1ccc(cc1N)Cl 1P00265U [0,1,0,0,0,1|1,0,0]=3 4648 B12R1.233 OC(=O)Cc1ccc(cc1O)Br 1P000S96 [0,1,0,0,0,1|0,0,0]=2 4649 B12R1.233 OC(=O)Cc1ccc(cc1O)O 1P00EDBR [0,1,0,0,0,1|0,0,0]=2 4650 B12R1.233 OC(=O)Cc1ccc(nc1C)Cl 1P01A25U [0,1,0,0,0,1|2,0,0]=4 4651 B12R1.233 OC(=O)Cc1ccc(nc1Cl)C 1P01BBQW [0,1,0,0,0,1|2,0,0]=4 4652 B12R1.233 OC(=O)Cc1ccc(nc1Cl)Cl 1P01KKF5 [0,1,0,0,0,1|2,0,0]=4 4653 B12R1.233 OC(=O)Cc1ccc(nc1F)Cl 1P021OLF [0,1,0,0,0,1|2,0,0]=4 4654 B12R1.233 OC(=O)Cc1cnc(cc1C)Cl 1P028T6V [0,1,0,0,0,1|2,0,0]=4 4655 B12R1.233 OC(=O)Cc1cnc(cc1Cl)Cl 1P002CHN [0,1,0,0,0,1|2,0,0]=4 4656 B12R1.233 OC(=O)Cc1cnc(nc1O)C 1P01XF0W [0,1,0,0,0,1|2,0,0]=4 4657 B12R1.233 OC(=O)Cc1cnc(nc1O)N 1P00JBDN [0,1,0,0,0,1|2,0,0]=4 4658 B12R1.233 OC(=O)Cc1ncc(cc1F)F 1P01V8PF [0,1,0,0,0,1|2,0,0]=4 4659 B12R1.233 OC(=O)Cn1ccc(=O)cc1C 1P028TER [0,1,0,0,0,1|2,0,0]=4 4660 B12R1.233 OC(=O)Cn1ccc(cc1=O)Br 1P01BYC9 [0,1,0,0,0,1|1,0,1]=4 4661 B12R1.233 OC(=O)Cn1ccc(cc1=O)C 1P01BFM4 [0,1,0,0,0,1|1,0,1]=4 4662 B12R1.371 BrCC(=O)Nc1ccccc1F 1P005EZT [0,1,0,0,0,1|2,0,0]=4 4663 B12R1.371 C=CC(=O)Cc1ccccc1F 1P01A48W [0,1,0,0,0,1|2,0,0]=4 4664 B12R1.371 C=CC(=O)Nc1ccccc1C 1P019SOX [0,1,0,0,0,1|2,0,0]=4 4665 B12R1.371 C=CC(=O)Nc1ccccc1F 1P00E8FK [0,1,0,0,0,1|2,0,0]=4 4666 B12R1.371 CCC(=O)Cc1ccccc1Br 1P019RG4 [0,1,0,0,0,1|2,0,0]=4 4667 B12R1.371 CCC(=O)Cc1ccccc1C 1P01HPJJ [0,1,0,0,0,1|2,0,0]=4 4668 B12R1.371 CCC(=O)Cc1ccccc1F 1P01EUOT [0,1,0,0,0,1|2,0,0]=4 4669 B12R1.371 CCC(=O)Nc1ccccc1Br 1P00EEMQ [0,1,0,0,0,1|2,0,0]=4 4670 B12R1.371 CCC(=O)Nc1ccccc1N 1P009RRN [0,1,0,0,0,1|2,0,0]=4 4671 B12R1.371 CCC(=O)Nc1ccccc1O 1P006A0L [0,1,0,0,0,1|1,0,0]=3 4672 B12R1.371 CCC(=O)Oc1ccccc1O 1P02924J [0,1,0,0,0,1|1,0,0]=3 4673 B12R1.371 CNC(=O)Cc1ccccc1Cl 1P00IKSY [0,1,0,0,0,1|2,0,0]=4 4674 B12R1.371 CNC(=O)Cc1ccccc1N 1P00C8RJ [0,1,0,0,0,1|2,0,0]=4 4675 B12R1.371 COC(=O)Cc1ccccc1Br 1P00EBRK [0,1,0,0,0,1|1,0,0]=3 4676 B12R1.371 COC(=O)Cc1ccccc1C 1P003SIA [0,1,0,0,0,1|1,0,0]=3 4677 B12R1.371 COC(=O)Cc1ccccc1Cl 1P003S4A [0,1,0,0,0,1|1,0,0]=3 4678 B12R1.371 COC(=O)Cc1ccccc1F 1P00393Q [0,1,0,0,0,1|1,0,0]=3 4679 B12R1.371 COC(=O)Cc1ccccc1I 1P00IC25 [0,1,0,0,0,1|1,0,0]=3 4680 B12R1.371 COC(=O)Cc1ccccc1N 1P00C63Y [0,1,0,0,0,1|1,0,0]=3 4681 B12R1.371 COC(=O)Cc1ccccc1N 1P00DG0W [0,1,0,0,0,1|1,0,0]=3 4682 B12R1.371 COC(=O)Cc1ccccc1O 1P0037ZQ [0,1,0,0,0,1|0,0,0]=2 4683 B12R1.371 COC(=O)Cc1cccnc1Cl 1P01XGGS [0,1,0,0,0,1|2,0,0]=4 4684 B12R1.371 COC(=O)Cc1ccncc1Br 1P00AKXN [0,1,0,0,0,1|2,0,0]=4 4685 B12R1.371 COC(=O)Cc1cncnc1O 1P01KWJZ [0,1,0,0,0,1|2,0,0]=4 4686 B12R1.371 COC(=O)Cc1ncccc1Br 1P002GMY [0,1,0,0,0,1|2,0,0]=4 4687 B12R1.371 COC(=O)Cc1ncccc1C 1P00HBUV [0,1,0,0,0,1|2,0,0]=4 4688 B12R1.371 COC(=O)Nc1ccccc1Br 1P00N987 [0,1,0,0,0,1|1,0,0]=3 4689 B12R1.371 COC(=O)Nc1ccccc1O 1P019V5N [0,1,0,0,0,1|0,0,0]=2 4690 B12R1.371 Cc1ccncc1NC(=O)OC 1P005ZM5 [0,1,0,0,0,1|2,0,0]=4 4691 B12R1.371 Cc1ccncc1NC(=O)OC 1P01BGQ9 [0,1,0,0,0,1|2,0,0]=4 4692 B12R1.371 ClCC(=O)Cc1ccccc1Br 1P00JTSB [0,1,0,0,0,1|2,0,0]=4 4693 B12R1.371 ClCC(=O)Cc1ccccc1C 1P00JTS6 [0,1,0,0,0,1|2,0,0]=4 4694 B12R1.371 ClCC(=O)Cc1ccccc1Cl 1P000YKD [0,1,0,0,0,1|2,0,0]=4 4695 B12R1.371 ClCC(=O)Cc1ccccc1F 1P00JTRX [0,1,0,0,0,1|2,0,0]=4 4696 B12R1.371 ClCC(=O)Nc1ccccc1Br 1P00EJAI [0,1,0,0,0,1|2,0,0]=4 4697 B12R1.371 ClCC(=O)Nc1ccccc1C 1P00BZLF [0,1,0,0,0,1|2,0,0]=4 4698 B12R1.371 ClCC(=O)Nc1ccccc1Cl 1P007J23 [0,1,0,0,0,1|2,0,0]=4 4699 B12R1.371 ClCC(=O)Nc1ccccc1F 1P007CAO [0,1,0,0,0,1|2,0,0]=4 4700 B12R1.371 ClCC(=O)Nc1ccccc1I 1P00FM48 [0,1,0,0,0,1|2,0,0]=4 4701 B12R1.371 ClCC(=O)Nc1ccccc1O 1P00050Z [0,1,0,0,0,1|1,0,0]=3 4702 B12R1.371 NCC(=O)Nc1ccccc1Br 1P00HAUJ [0,1,0,0,0,1|2,0,0]=4 4703 B12R1.371 NCC(=O)Nc1ccccc1C 1P00J46J [0,1,0,0,0,1|2,0,0]=4 4704 B12R1.371 NCC(=O)Nc1ccccc1F 1P0289BO [0,1,0,0,0,1|2,0,0]=4 4705 B12R1.371 NNC(=O)Cc1ccccc1C 1P00JDOV [0,1,0,0,0,1|2,0,0]=4 4706 B12R1.371 NNC(=O)Cc1ccccc1Cl 1P00BCNA [0,1,0,0,0,1|2,0,0]=4 4707 B12R1.371 NNC(=O)Cc1ccccc1F 1P0097A6 [0,1,0,0,0,1|2,0,0]=4 4708 B12R1.371 NNC(=O)Cc1ccccc1O 1P01B60T [0,1,0,0,0,1|1,0,0]=3 4709 B12R1.371 NNC(=O)Nc1ccccc1C 1P019NCX [0,1,0,0,0,1|2,0,0]=4 4710 B12R1.371 NNC(=O)Nc1ccccc1Cl 1P00C9G6 [0,1,0,0,0,1|2,0,0]=4 4711 B12R1.371 O=C\C(=C\c1ccccc1F)\C 1P00141I [0,1,0,0,0,1|2,0,0]=4 4712 B12R1.371 ON=C(Cc1ccccc1Cl)N 1P019VPD [0,1,0,0,0,1|2,0,0]=4 4713 B12R1.371 ON=C(Cc1ccccc1F)N 1P01BUD3 [0,1,0,0,0,1|2,0,0]=4 4714 B12R1.371 ONC(=N)Cc1ccccc1Br 1P00IGDR [0,1,0,0,0,1|2,0,0]=4 4715 B12R1.371 ONC(=N)Cc1ccccc1C 1P00D7H0 [0,1,0,0,0,1|2,0,0]=4 4716 B12R1.371 ONC(=O)Cc1ccccc1C 1P019XJJ [0,1,0,0,0,1|1,0,0]=3 4717 B12R1.371 ONC(=O)Cc1ccccc1Cl 1P019XEQ [0,1,0,0,0,1|1,0,0]=3 4718 B12R1.371 Oc1ncccc1NC(=O)CCl 1P00940U [0,1,0,0,0,1|2,0,0]=4 4719 B12R1.371 SCC(=O)Nc1ccccc1F 1P00I4OM [0,1,0,0,0,1|1,1,0]=4 4720 B12R1.1009 CC(=O)Cc1c(Cl)cccc1Cl 1P003GKE [0,1,0,0,0,1|2,0,0]=4 4721 B12R1.1009 CC(=O)Nc1c(C)cccc1C 1P003SP2 [0,1,0,0,0,1|2,0,0]=4 4722 B12R1.1009 CC(=O)Nc1c(C)cccc1F 1P021S6H [0,1,0,0,0,1|2,0,0]=4 4723 B12R1.1009 CC(=O)Nc1c(C)cccc1O 1P00588T [0,1,0,0,0,1|1,0,0]=3 4724 B12R1.1009 CC(=O)Nc1c(Cl)cccc1Cl 1P0025IX [0,1,0,0,0,1|2,0,0]=4 4725 B12R1.1009 ClC(=O)Cc1c(Cl)cccc1Cl 1P00JLHW [0,1,0,0,0,1|2,0,0]=4 4726 B12R1.1009 NC(=O)Cc1c(Cl)cccc1Cl 1P005BKG [0,1,0,0,0,1|2,0,0]=4 4727 B12R1.1009 NC(=O)Cc1c(F)cccc1Cl 1P01AB0B [0,1,0,0,0,1|2,0,0]=4 4728 B12R1.1009 NC(=O)Cc1c(F)cccc1F 1P0091YL [0,1,0,0,0,1|2,0,0]=4 4729 B12R1.1009 NC(=O)Nc1c(Cl)cccc1Cl 1P01B5HD [0,1,0,0,0,1|2,0,0]=4 4730 B12R1.1009 OC(=O)Cc1c(Br)cccc1Br 1P006JKN [0,1,0,0,0,1|1,0,0]=3 4731 B12R1.1009 OC(=O)Cc1c(C)cccc1Br 1P0293R0 [0,1,0,0,0,1|1,0,0]=3 4732 B12R1.1009 OC(=O)Cc1c(C)cccc1C 1P00H1GQ [0,1,0,0,0,1|1,0,0]=3 4733 B12R1.1009 OC(=O)Cc1c(C)cccc1Cl 1P01BDLE [0,1,0,0,0,1|1,0,0]=3 4734 B12R1.1009 OC(=O)Cc1c(Cl)cccc1Br 1P01AVGQ [0,1,0,0,0,1|1,0,0]=3 4735 B12R1.1009 OC(=O)Cc1c(Cl)cccc1Cl 1P003GJW [0,1,0,0,0,1|1,0,0]=3 4736 B12R1.1009 OC(=O)Cc1c(Cl)cncc1Cl 1P00BJ7L [0,1,0,0,0,1|2,0,0]=4 4737 B12R1.1009 OC(=O)Cc1c(F)cccc1Br 1P009GXH [0,1,0,0,0,1|1,0,0]=3 4738 B12R1.1009 OC(=O)Cc1c(F)cccc1Cl 1P003HH6 [0,1,0,0,0,1|1,0,0]=3 4739 B12R1.1009 OC(=O)Cc1c(F)cccc1F 1P0033IB [0,1,0,0,0,1|1,0,0]=3 4740 B12R1.1009 OC(=O)Cc1c(F)cncc1Cl 1P01A56N [0,1,0,0,0,1|2,0,0]=4 4741 B12R1.1009 OC(=O)Cc1c(O)ncnc1O 1P019Q8K [0,1,0,0,0,1|2,0,0]=4 4742 B12R1.46 C#Cc1ccc(cc1C(=O)O)F 1P028ZJQ [0,2,0,0,0,0|1,0,0]=3 4743 B12R1.46 CC(=O)c1cc(Br)cnc1OC 1P000OV9 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.46 CCc1ccc(cc1C(=O)O)Br 1P00DL4T [0,2,0,0,0,0|1,0,0]=3 4745 B12R1.46 CCc1ccc(cc1C(=O)O)C 1P028TCK [0,2,0,0,0,0|1,0,0]=3 4746 B12R1.46 CCc1ccc(cc1C(=O)O)F 1P01BS29 [0,2,0,0,0,0|1,0,0]=3 4747 B12R1.46 CCc1ncc(cc1C(=O)O)Br 1P028KX2 [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.46 CCc1ncc(cc1C(=O)O)Cl 1P01BSEF [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.46 CNc1ccc(cc1C(=O)N)Br 1P00BNU2 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.46 CNc1ccc(cc1C(=O)O)Br 1P00BIIW [0,2,0,0,0,0|1,0,0]=3 4751 B12R1.46 CNc1ccc(cc1C(=O)O)Cl 1P00C6L0 [0,2,0,0,0,0|1,0,0]=3 4752 B12R1.46 CNc1ccc(cc1C(=O)O)F 1P01AAPS [0,2,0,0,0,0|1,0,0]=3 4753 B12R1.46 CNc1ncc(cc1C(=O)O)N 1P0291MB [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.46 COc1ccc(cc1B(O)O)Br 1P0088TZ [0,2,0,0,0,0|1,0,1]=4 4755 B12R1.46 COc1ccc(cc1B(O)O)C 1P000Y3J [0,2,0,0,0,0|1,0,1]=4 4756 B12R1.46 COc1ccc(cc1B(O)O)Cl 1P0034PK [0,2,0,0,0,0|1,0,1]=4 4757 B12R1.46 COc1ccc(cc1B(O)O)F 1P0027TF [0,2,0,0,0,0|1,0,1]=4 4758 B12R1.46 COc1ccc(cc1B(O)O)I 1P00HIUL [0,2,0,0,0,0|1,0,1]=4 4759 B12R1.46 COc1ccc(cc1B(O)O)N 1P028FP6 [0,2,0,0,0,0|1,0,1]=4 4760 B12R1.46 COc1ccc(cc1C(=N)N)Cl 1P001VHJ [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.46 COc1ccc(cc1C(=O)C)Br 1P001XTH [0,2,0,0,0,0|1,0,0]=3 4762 B12R1.46 COc1ccc(cc1C(=O)C)C 1P002IVJ [0,2,0,0,0,0|1,0,0]=3 4763 B12R1.46 COc1ccc(cc1C(=O)C)Cl 1P00EAOD [0,2,0,0,0,0|1,0,0]=3 4764 B12R1.46 COc1ccc(cc1C(=O)C)F 1P003MS3 [0,2,0,0,0,0|1,0,0]=3 4765 B12R1.46 COc1ccc(cc1C(=O)C)O 1P00CZ5I [0,2,0,0,0,0|1,0,0]=3 4766 B12R1.46 COc1ccc(cc1C(=O)Cl)Cl 1P002Z8N [0,2,0,0,0,0|1,0,0]=3 4767 B12R1.46 COc1ccc(cc1C(=O)Cl)F 1P00FI51 [0,2,0,0,0,0|1,0,0]=3 4768 B12R1.46 COc1ccc(cc1C(=O)N)Br 1P00303O [0,2,0,0,0,0|1,0,0]=3 4769 B12R1.46 COc1ccc(cc1C(=O)N)N 1P002M5G [0,2,0,0,0,0|1,0,0]=3 4770 B12R1.46 COc1ccc(cc1C(=O)O)Br 1P002PTN [0,2,0,0,0,0|0,0,0]=2 4771 B12R1.46 COc1ccc(cc1C(=O)O)C 1P002QPW [0,2,0,0,0,0|0,0,0]=2 4772 B12R1.46 COc1ccc(cc1C(=O)O)Cl 1P003N3T [0,2,0,0,0,0|0,0,0]=2 4773 B12R1.46 COc1ccc(cc1C(=O)O)F 1P0034QC [0,2,0,0,0,0|0,0,0]=2 4774 B12R1.46 COc1ccc(cc1C(=O)O)I 1P002VFQ [0,2,0,0,0,0|0,0,0]=2 4775 B12R1.46 COc1ccc(cc1C(=O)O)N 1P00C7FL [0,2,0,0,0,0|0,0,0]=2 4776 B12R1.46 COc1ccc(cc1C(=O)O)N 1P00J2CG [0,2,0,0,0,0|0,0,0]=2 4777 B12R1.46 COc1ccc(cc1C(=O)O)O 1P00EZ3A [0,2,0,0,0,0|0,0,0]=2 4778 B12R1.46 COc1ccc(cc1C(=S)N)Br 1P019K2E [0,2,0,0,0,0|1,1,0]=4 4779 B12R1.46 COc1ccc(cc1C(O)C)C 1P01AGDT [0,2,0,0,0,0|1,0,1]=4 4780 B12R1.46 COc1ccc(cc1C(O)C)Cl 1P00VUE5 [0,2,0,0,0,0|1,0,1]=4 4781 B12R1.46 COc1ccc(cc1S(=O)[O-])C 1P01ANB4 [0,2,0,0,0,0|1,0,1]=4 4782 B12R1.46 COc1ccc(cc1[C@@H](O)C)C 1P019R2R [0,2,0,0,0,0|1,0,1]=4 4783 B12R1.46 COc1ccc(cc1[C@@H](O)C)F 1P01X042 [0,2,0,0,0,0|1,0,1]=4 4784 B12R1.46 COc1ccc(cc1[C@H](O)C)C 1P019R2S [0,2,0,0,0,0|1,0,1]=4 4785 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Br 1P00BZYD [0,2,0,0,0,0|1,0,1]=4 4786 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C 1P003M6R [0,2,0,0,0,0|1,0,1]=4 4787 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Cl 1P0044AB [0,2,0,0,0,0|1,0,1]=4 4788 B12R1.46 COc1ccc(cc1[N+](=O)[O-])F 1P00720W [0,2,0,0,0,0|1,0,1]=4 4789 B12R1.46 COc1ccc(cc1[N+](=O)[O-])I 1P00D8ID [0,2,0,0,0,0|1,0,1]=4 4790 B12R1.46 COc1ccc(cc1[N+](=O)[O-])N 1P003M3H [0,2,0,0,0,0|1,0,1]=4 4791 B12R1.46 COc1ccc(cc1[N+](=O)[O-])O 1P0039DW [0,2,0,0,0,0|1,0,1]=4 4792 B12R1.46 COc1ccc(nc1C(=O)C)C 1P028RWP [0,2,0,0,0,0|2,0,0]=4 4793 B12R1.46 COc1ccc(nc1C(=O)O)Br 1P000OVG [0,2,0,0,0,0|1,0,0]=3 4794 B12R1.46 COc1ccc(nc1C(=O)O)C 1P01H731 [0,2,0,0,0,0|1,0,0]=3 4795 B12R1.46 COc1ccc(nc1C(=O)O)C 1P02871E [0,2,0,0,0,0|1,0,0]=3 4796 B12R1.46 COc1cnc(cc1C(=O)C)Cl 1P0287YW [0,2,0,0,0,0|2,0,0]=4 4797 B12R1.46 COc1cnc(cc1C(=O)O)Br 1P000OSX [0,2,0,0,0,0|1,0,0]=3 4798 B12R1.46 COc1cnc(cc1C(=O)O)Cl 1P0094E7 [0,2,0,0,0,0|1,0,0]=3 4799 B12R1.46 COc1cnc(cc1C(=O)O)F 1P01C2DH [0,2,0,0,0,0|1,0,0]=3 4800 B12R1.46 COc1cnc(nc1C(=O)O)C 1P000ALZ [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.46 COc1ncc(cc1C(=O)C)C 1P00HFVJ [0,2,0,0,0,0|2,0,0]=4 4802 B12R1.46 COc1ncc(cc1C(=O)N)N 1P019Z4M [0,2,0,0,0,0|2,0,0]=4 4803 B12R1.46 COc1ncc(cc1C(=O)O)Br 1P003MY7 [0,2,0,0,0,0|1,0,0]=3 4804 B12R1.46 COc1ncc(cc1C(=O)O)C 1P000JTV [0,2,0,0,0,0|1,0,0]=3 4805 B12R1.46 COc1ncc(cc1C(=O)O)Cl 1P0037P9 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.46 COc1ncc(cc1C(=O)O)F 1P004F31 [0,2,0,0,0,0|1,0,0]=3 4807 B12R1.46 COc1ncc(cc1C(=O)O)I 1P00HWCO [0,2,0,0,0,0|1,0,0]=3 4808 B12R1.46 CSc1ccc(cc1C(=O)C)Br 1P02939Q [0,2,0,0,0,0|1,1,0]=4 4809 B12R1.46 CSc1ccc(cc1C(=O)C)C 1P0293GN [0,2,0,0,0,0|1,1,0]=4 4810 B12R1.46 CSc1ccc(cc1C(=O)O)Br 1P00IBG8 [0,2,0,0,0,0|0,1,0]=3 4811 B12R1.46 CSc1ccc(cc1C(=O)O)N 1P01BJ6B [0,2,0,0,0,0|0,1,0]=3 4812 B12R1.46 N#Cc1ccc(cc1C(=O)O)Br 1P008ZHN [0,2,0,0,0,0|1,0,0]=3 4813 B12R1.46 N#Cc1ccc(cc1C(=O)O)F 1P00DC73 [0,2,0,0,0,0|1,0,0]=3 4814 B12R1.46 N#Cc1ccc(cc1C(=O)O)N 1P001WG5 [0,2,0,0,0,0|1,0,0]=3 4815 B12R1.46 N#Cc1cnc(cc1C(=O)O)Cl 1P01ELWV [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.46 NCc1ccc(cc1C(=O)O)N 1P027ZQ6 [0,2,0,0,0,0|1,0,0]=3 4817 B12R1.46 NNc1ccc(cc1C(=O)O)Br 1P01KL92 [0,2,0,0,0,0|1,0,0]=3 4818 B12R1.46 NNc1ccc(cc1C(=O)O)F 1P01XA8L [0,2,0,0,0,0|1,0,0]=3 4819 B12R1.46 O=Cc1ccc(cc1C(=O)C)Br 1P028ZBQ [0,2,0,0,0,0|1,0,1]=4 4820 B12R1.46 O=Cc1ccc(cc1C(=O)C)C 1P028SC6 [0,2,0,0,0,0|1,0,1]=4 4821 B12R1.46 O=Cc1ccc(cc1C(=O)C)F 1P028ZCP [0,2,0,0,0,0|1,0,1]=4 4822 B12R1.46 O=Cc1ccc(cc1C(=O)O)Br 1P006Z54 [0,2,0,0,0,0|0,0,1]=3 4823 B12R1.46 O=Cc1ccc(cc1C(=O)O)C 1P01BQ32 [0,2,0,0,0,0|0,0,1]=3 4824 B12R1.46 O=Cc1ccc(cc1C(=O)O)Cl 1P00DCB6 [0,2,0,0,0,0|0,0,1]=3 4825 B12R1.46 O=Cc1ccc(cc1C(=O)O)F 1P00GVYM [0,2,0,0,0,0|0,0,1]=3 4826 B12R1.46 O=[I]c1ccc(cc1C(=O)O)C 1P018TTK [0,2,0,0,0,0|0,0,1]=3 4827 B12R1.46 OC(=O)c1cc(Br)cnc1C#N 1P00IH6L [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.46 OCc1ccc(cc1B(O)O)F 1P000N0N [0,2,0,0,0,0|1,0,1]=4 4829 B12R1.46 OCc1ccc(cc1B(O)O)N 1P0251BF [0,2,0,0,0,0|1,0,1]=4 4830 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])Br 1P00I4Z3 [0,2,0,0,0,0|1,0,1]=4 4831 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])C 1P00BGMB [0,2,0,0,0,0|1,0,1]=4 4832 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])Cl 1P003LKP [0,2,0,0,0,0|1,0,1]=4 4833 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])F 1P008SZV [0,2,0,0,0,0|1,0,1]=4 4834 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])I 1P00BEE9 [0,2,0,0,0,0|1,0,1]=4 4835 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])N 1P002M9I [0,2,0,0,0,0|1,0,1]=4 4836 B12R1.46 OCc1ccc(cc1[N+](=O)[O-])O 1P008G7I [0,2,0,0,0,0|1,0,1]=4 4837 B12R1.57 C=Cc1cc(Cl)ccc1C(=O)N 1P01DVOU [0,2,0,0,0,0|2,0,0]=4 4838 B12R1.57 CCc1cc(Br)ccc1C(=O)C 1P027W20 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.57 CCc1cc(Br)ccc1C(=O)O 1P00EOPF [0,2,0,0,0,0|1,0,0]=3 4840 B12R1.57 CCc1cc(C)ccc1C(=O)O 1P01NXVY [0,2,0,0,0,0|1,0,0]=3 4841 B12R1.57 CCc1cc(F)ccc1C(=O)O 1P024F6B [0,2,0,0,0,0|1,0,0]=3 4842 B12R1.57 CCc1cc(N)ccc1C(=O)O 1P01EBOV [0,2,0,0,0,0|1,0,0]=3 4843 B12R1.57 CNc1cc(Br)ccc1C(=O)N 1P01XAJ6 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.57 CNc1cc(Br)ccc1C(=O)O 1P00IEE8 [0,2,0,0,0,0|1,0,0]=3 4845 B12R1.57 CNc1cc(Cl)ccc1C(=O)O 1P00DIFH [0,2,0,0,0,0|1,0,0]=3 4846 B12R1.57 CNc1cc(I)ccc1C(=O)O 1P01ANEA [0,2,0,0,0,0|1,0,0]=3 4847 B12R1.57 CNc1nc(C)ccc1C(=O)O 1P001OO3 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.57 COc1cc(=O)[nH]cc1C(=O)O 1P01C9PD [0,2,0,0,0,0|1,0,0]=3 4849 B12R1.57 COc1cc(Br)ccc1B(O)O 1P0089HE [0,2,0,0,0,0|1,0,1]=4 4850 B12R1.57 COc1cc(Br)ccc1C(=O)C 1P003L23 [0,2,0,0,0,0|1,0,0]=3 4851 B12R1.57 COc1cc(Br)ccc1C(=O)N 1P00GA2F [0,2,0,0,0,0|1,0,0]=3 4852 B12R1.57 COc1cc(Br)ccc1C(=O)O 1P0034E8 [0,2,0,0,0,0|0,0,0]=2 4853 B12R1.57 COc1cc(Br)ccc1[N+](=O)[O-] 1P003MYI [0,2,0,0,0,0|1,0,1]=4 4854 B12R1.57 COc1cc(Br)cnc1C(=O)C 1P01DMMT [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.57 COc1cc(Br)cnc1C(=O)N 1P028496 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.57 COc1cc(Br)cnc1C(=O)O 1P000BBG [0,2,0,0,0,0|1,0,0]=3 4857 B12R1.57 COc1cc(Br)ncc1C(=O)O 1P01JVZC [0,2,0,0,0,0|1,0,0]=3 4858 B12R1.57 COc1cc(C)ccc1B(O)O 1P002BUD [0,2,0,0,0,0|1,0,1]=4 4859 B12R1.57 COc1cc(C)ccc1C(=O)C 1P007AFZ [0,2,0,0,0,0|1,0,0]=3 4860 B12R1.57 COc1cc(C)ccc1C(=O)O 1P003BPH [0,2,0,0,0,0|0,0,0]=2 4861 B12R1.57 COc1cc(C)ccc1C(O)C 1P01AGEQ [0,2,0,0,0,0|1,0,1]=4 4862 B12R1.57 COc1cc(C)ccc1[C@@H](O)C 1P01AGOK [0,2,0,0,0,0|1,0,1]=4 4863 B12R1.57 COc1cc(C)ccc1[C@H](O)C 1P01AGO8 [0,2,0,0,0,0|1,0,1]=4 4864 B12R1.57 COc1cc(C)ccc1[N+](=O)[O-] 1P0079SF [0,2,0,0,0,0|1,0,1]=4 4865 B12R1.57 COc1cc(C)cnc1C(=O)O 1P000OUY [0,2,0,0,0,0|1,0,0]=3 4866 B12R1.57 COc1cc(C)ncc1C(=O)O 1P024V4C [0,2,0,0,0,0|1,0,0]=3 4867 B12R1.57 COc1cc(Cl)ccc1B(O)O 1P00370P [0,2,0,0,0,0|1,0,1]=4 4868 B12R1.57 COc1cc(Cl)ccc1C(=O)C 1P00EKSX [0,2,0,0,0,0|1,0,0]=3 4869 B12R1.57 COc1cc(Cl)ccc1C(=O)Cl 1P01GHKU [0,2,0,0,0,0|1,0,0]=3 4870 B12R1.57 COc1cc(Cl)ccc1C(=O)O 1P003LK7 [0,2,0,0,0,0|0,0,0]=2 4871 B12R1.57 COc1cc(Cl)ccc1[N+](=O)[O-] 1P00FC0L [0,2,0,0,0,0|1,0,1]=4 4872 B12R1.57 COc1cc(Cl)cnc1C(=O)O 1P000OSY [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.57 COc1cc(Cl)ncc1C(=O)C 1P01JZJH [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.57 COc1cc(Cl)ncc1C(=O)O 1P003NMM [0,2,0,0,0,0|1,0,0]=3 4875 B12R1.57 COc1cc(F)ccc1B(O)O 1P0027T1 [0,2,0,0,0,0|1,0,1]=4 4876 B12R1.57 COc1cc(F)ccc1C(=O)C 1P00DA74 [0,2,0,0,0,0|1,0,0]=3 4877 B12R1.57 COc1cc(F)ccc1C(=O)N 1P00IF36 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.57 COc1cc(F)ccc1C(=O)O 1P00398F [0,2,0,0,0,0|0,0,0]=2 4879 B12R1.57 COc1cc(F)ccc1[C@@H](O)C 1P01AKEH [0,2,0,0,0,0|1,0,1]=4 4880 B12R1.57 COc1cc(F)ccc1[C@H](O)C 1P01AKZ3 [0,2,0,0,0,0|1,0,1]=4 4881 B12R1.57 COc1cc(F)ccc1[N+](=O)[O-] 1P003N7W [0,2,0,0,0,0|1,0,1]=4 4882 B12R1.57 COc1cc(I)ccc1C(=O)O 1P003M0Y [0,2,0,0,0,0|0,0,0]=2 4883 B12R1.57 COc1cc(I)ccc1[N+](=O)[O-] 1P00IECJ [0,2,0,0,0,0|1,0,1]=4 4884 B12R1.57 COc1cc(N)ccc1C(=O)C 1P00EKSY [0,2,0,0,0,0|1,0,0]=3 4885 B12R1.57 COc1cc(N)ccc1C(=O)O 1P002Q4X [0,2,0,0,0,0|0,0,0]=2 4886 B12R1.57 COc1cc(N)ccc1[N+](=O)[O-] 1P00ABYA [0,2,0,0,0,0|1,0,1]=4 4887 B12R1.57 COc1cc(N)ccc1[N+](=O)[O-] 1P027S5E [0,2,0,0,0,0|1,0,1]=4 4888 B12R1.57 COc1cc(O)ccc1C(=O)C 1P00DLQ6 [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.57 COc1cc(O)ccc1C(=O)O 1P019GD7 [0,2,0,0,0,0|0,0,0]=2 4890 B12R1.57 COc1cc(O)ccc1[N+](=O)[O-] 1P007X13 [0,2,0,0,0,0|1,0,1]=4 4891 B12R1.57 COc1nc(Br)ccc1C(=O)O 1P0095OP [0,2,0,0,0,0|1,0,0]=3 4892 B12R1.57 COc1nc(C)ccc1C(=O)O 1P00FIB6 [0,2,0,0,0,0|1,0,0]=3 4893 B12R1.57 COc1nc(C)cnc1C(=O)O 1P0293KN [0,2,0,0,0,0|2,0,0]=4 4894 B12R1.57 COc1nc(C)ncc1C(=O)O 1P01C5QS [0,2,0,0,0,0|2,0,0]=4 4895 B12R1.57 COc1nc(Cl)ccc1C(=O)O 1P00390S [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.57 COc1nc(N)ccc1C(=O)O 1P008TD8 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.57 COc1nc(N)ncc1C(=O)O 1P0066ID [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.57 CSc1cc(Br)ccc1C(=O)O 1P01B2YO [0,2,0,0,0,0|0,1,0]=3 4899 B12R1.57 CSc1cc(C)ccc1C(=O)O 1P002Q4F [0,2,0,0,0,0|0,1,0]=3 4900 B12R1.57 CSc1cc(F)ccc1C(=O)O 1P019VMD [0,2,0,0,0,0|0,1,0]=3 4901 B12R1.57 CSc1cc(N)ccc1C(=O)O 1P028Z1V [0,2,0,0,0,0|0,1,0]=3 4902 B12R1.57 CSc1nc(Cl)ccc1C(=O)O 1P019U6M [0,2,0,0,0,0|1,1,0]=4 4903 B12R1.57 N#Cc1cc(Br)ccc1C(=O)O 1P0017KY [0,2,0,0,0,0|1,0,0]=3 4904 B12R1.57 N#Cc1cc(C)ccc1C(=O)O 1P000JE2 [0,2,0,0,0,0|1,0,0]=3 4905 B12R1.57 N#Cc1cc(F)ccc1C(=O)C 1P01NV29 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.57 N#Cc1cc(F)ccc1C(=O)O 1P0015CZ [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.57 N#Cc1cc(N)ccc1C(=O)O 1P00133M [0,2,0,0,0,0|1,0,0]=3 4908 B12R1.57 NNc1cc(Br)ccc1C(=O)O 1P01ENMT [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.57 NNc1cc(C)ccc1C(=O)O 1P028GI8 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.57 O=Cc1cc(Br)ccc1C(=O)C 1P028Q3K [0,2,0,0,0,0|1,0,1]=4 4911 B12R1.57 O=Cc1cc(Br)ccc1C(=O)O 1P0036NY [0,2,0,0,0,0|0,0,1]=3 4912 B12R1.57 O=Cc1cc(C)ccc1C(=O)C 1P005ZJ9 [0,2,0,0,0,0|1,0,1]=4 4913 B12R1.57 O=Cc1cc(Cl)ccc1C(=O)O 1P01E4ZH [0,2,0,0,0,0|0,0,1]=3 4914 B12R1.57 O=Cc1cc(Cl)ncc1C(=O)O 1P009419 [0,2,0,0,0,0|1,0,1]=4 4915 B12R1.57 O=Cc1cc(F)ccc1C(=O)C 1P028Z4M [0,2,0,0,0,0|1,0,1]=4 4916 B12R1.57 O=Cc1cc(F)ccc1C(=O)O 1P01AM8E [0,2,0,0,0,0|0,0,1]=3 4917 B12R1.57 OCc1cc(Br)ccc1C(=O)O 1P00FKBS [0,2,0,0,0,0|0,0,0]=2 4918 B12R1.57 OCc1cc(Br)ccc1[N+](=O)[O-] 1P000M3A [0,2,0,0,0,0|1,0,1]=4 4919 B12R1.57 OCc1cc(C)ccc1[N+](=O)[O-] 1P003CEV [0,2,0,0,0,0|1,0,1]=4 4920 B12R1.57 OCc1cc(Cl)ccc1[N+](=O)[O-] 1P005NIA [0,2,0,0,0,0|1,0,1]=4 4921 B12R1.57 OCc1cc(F)ccc1B(O)O 1P0038PI [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.57 OCc1cc(F)ccc1C(=O)O 1P01V85M [0,2,0,0,0,0|0,0,0]=2 4923 B12R1.57 OCc1cc(F)ccc1[N+](=O)[O-] 1P002WO7 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.57 OCc1cc(N)ccc1[N+](=O)[O-] 1P0054EO [0,2,0,0,0,0|1,0,1]=4 4925 B12R1.57 OCc1cc(O)ccc1[N+](=O)[O-] 1P00EAT7 [0,2,0,0,0,0|1,0,1]=4 4926 B12R1.76 C=Cc1ccccc1S(=O)(=O)O 1P00C65Q [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.76 CCc1ccccc1S(=O)(=O)O 1P006PVW [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.76 COc1ccccc1C(O)(C)C 1P01AAT1 [0,2,0,0,0,0|1,0,1]=4 4929 B12R1.76 COc1ccccc1S(=O)(=N)C 1P01B7JX [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.76 COc1ccccc1S(=O)(=O)C 1P0013MY [0,2,0,0,0,0|1,0,1]=4 4931 B12R1.76 COc1ccccc1S(=O)(=O)Cl 1P0004N5 [0,2,0,0,0,0|1,0,1]=4 4932 B12R1.76 COc1ccccc1S(=O)(=O)N 1P003A98 [0,2,0,0,0,0|1,0,1]=4 4933 B12R1.76 OCc1ccccc1S(=O)(=O)C 1P003FJY [0,2,0,0,0,0|1,0,1]=4 4934 B12R1.76 OCc1ccccc1S(=O)(=O)N 1P00EOJO [0,2,0,0,0,0|1,0,1]=4 4935 B12R1.76 OCc1ccccc1S(=O)(=O)[O-] 1P01DWSN [0,2,0,0,0,0|1,0,1]=4 4936 B12R1.77 BrCC(=O)c1ccccc1C#N 1P005ROV [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.77 BrCC(=O)c1ccccc1OC 1P003H30 [0,2,0,0,0,0|1,0,0]=3 4938 B12R1.77 C=CC(c1ccccc1OC)O 1P028WXC [0,2,0,0,0,0|1,0,1]=4 4939 B12R1.77 CCC(=O)c1ccccc1CC 1P001YD3 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.77 CNC(=O)c1ccccc1C=O 1P000EDL [0,2,0,0,0,0|1,0,1]=4 4941 B12R1.77 CNC(=O)c1ccccc1CO 1P00I8AZ [0,2,0,0,0,0|1,0,0]=3 4942 B12R1.77 CNC(=O)c1ccccc1NC 1P01BJ4F [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.77 CNC(=O)c1cccnc1OC 1P01DYYO [0,2,0,0,0,0|2,0,0]=4 4944 B12R1.77 COC(=O)c1cccc[n+]1OC 1P01EWY0 [0,2,0,0,0,0|1,0,0]=3 4945 B12R1.77 COC(=O)c1ccccc1C#C 1P003999 [0,2,0,0,0,0|1,0,0]=3 4946 B12R1.77 COC(=O)c1ccccc1C#N 1P003S4C [0,2,0,0,0,0|1,0,0]=3 4947 B12R1.77 COC(=O)c1ccccc1C=C 1P00BFT9 [0,2,0,0,0,0|1,0,0]=3 4948 B12R1.77 COC(=O)c1ccccc1C=O 1P003A3B [0,2,0,0,0,0|0,0,1]=3 4949 B12R1.77 COC(=O)c1ccccc1CBr 1P007OKT [0,2,0,0,0,0|1,0,0]=3 4950 B12R1.77 COC(=O)c1ccccc1CC 1P00DUHC [0,2,0,0,0,0|1,0,0]=3 4951 B12R1.77 COC(=O)c1ccccc1CCl 1P003S48 [0,2,0,0,0,0|1,0,0]=3 4952 B12R1.77 COC(=O)c1ccccc1CN 1P00G4Z9 [0,2,0,0,0,0|1,0,0]=3 4953 B12R1.77 COC(=O)c1ccccc1CS 1P01C64T [0,2,0,0,0,0|0,1,0]=3 4954 B12R1.77 COC(=O)c1ccccc1NC 1P004R73 [0,2,0,0,0,0|1,0,0]=3 4955 B12R1.77 COC(=O)c1ccccc1NN 1P00BEI6 [0,2,0,0,0,0|1,0,0]=3 4956 B12R1.77 COC(=O)c1ccccc1OC 1P003S56 [0,2,0,0,0,0|0,0,0]=2 4957 B12R1.77 COC(=O)c1ccccc1SC 1P007CSX [0,2,0,0,0,0|0,1,0]=3 4958 B12R1.77 COC(=O)c1ccccc1[N+]#[C-] 1P00FAYC [0,2,0,0,0,0|1,0,0]=3 4959 B12R1.77 COC(=O)c1cccnc1C#N 1P003S4D [0,2,0,0,0,0|2,0,0]=4 4960 B12R1.77 COC(=O)c1cccnc1C=O 1P00BJDW [0,2,0,0,0,0|1,0,1]=4 4961 B12R1.77 COC(=O)c1cccnc1CBr 1P000DX6 [0,2,0,0,0,0|2,0,0]=4 4962 B12R1.77 COC(=O)c1cccnc1CC 1P01K0MX [0,2,0,0,0,0|2,0,0]=4 4963 B12R1.77 COC(=O)c1cccnc1CCl 1P002604 [0,2,0,0,0,0|2,0,0]=4 4964 B12R1.77 COC(=O)c1cccnc1CN 1P00AMH7 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.77 COC(=O)c1cccnc1OC 1P003S57 [0,2,0,0,0,0|1,0,0]=3 4966 B12R1.77 COC(=O)c1ccncc1C#C 1P028I88 [0,2,0,0,0,0|2,0,0]=4 4967 B12R1.77 COC(=O)c1ccncc1C#N 1P007BUP [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.77 COC(=O)c1ccncc1C=C 1P01EMK4 [0,2,0,0,0,0|2,0,0]=4 4969 B12R1.77 COC(=O)c1ccncc1C=O 1P01KKMP [0,2,0,0,0,0|1,0,1]=4 4970 B12R1.77 COC(=O)c1ccncc1CBr 1P01KKX7 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.77 COC(=O)c1cnccc1CCl 1P000HTC [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.77 COC(=O)c1cnccc1OC 1P0005WM [0,2,0,0,0,0|1,0,0]=3 4973 B12R1.77 COC(=O)c1ncccc1C#C 1P000PT9 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.77 COC(=O)c1ncccc1C#N 1P00DEEI [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.77 COC(=O)c1ncccc1C=O 1P0014TI [0,2,0,0,0,0|1,0,1]=4 4976 B12R1.77 COC(=O)c1ncccc1CBr 1P000DX5 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.77 COC(=O)c1ncccc1CN 1P01ECSB [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.77 COC(=O)c1ncccc1OC 1P00C297 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.77 COC(=O)c1nccnc1OC 1P00CJWM [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.77 COC(=O)c1ncncc1OC 1P018I4I [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.77 COc1ncccc1C(=O)CBr 1P01BA86 [0,2,0,0,0,0|2,0,0]=4 4982 B12R1.77 FCC(=O)c1ccccc1OC 1P00C5J9 [0,2,0,0,0,0|1,0,0]=3 4983 B12R1.77 N#CC(=O)c1ccccc1OC 1P0067OG [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.77 NCC(=O)c1ccccc1CC 1P0280NB [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.77 NCC(=O)c1ccccc1OC 1P00CNEI [0,2,0,0,0,0|1,0,0]=3 4986 B12R1.77 NCC(c1ccccc1OC)O 1P004QTR [0,2,0,0,0,0|1,0,1]=4 4987 B12R1.77 NCC(c1ccccc1OC)O 1P00DNJ8 [0,2,0,0,0,0|1,0,1]=4 4988 B12R1.77 NC[C@@H](c1ccccc1OC)O 1P01B70K [0,2,0,0,0,0|1,0,1]=4 4989 B12R1.77 NC[C@H](c1ccccc1OC)O 1P01B7KW [0,2,0,0,0,0|1,0,1]=4 4990 B12R1.77 NCc1ncccc1C(=O)OC 1P028E5R [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.77 NNC(=O)c1ccccc1CO 1P00DDFR [0,2,0,0,0,0|1,0,0]=3 4992 B12R1.77 NNC(=O)c1ccccc1NC 1P00E2Z6 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.77 NNC(=O)c1ccccc1NC 1P01FJKX [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.77 NNC(=O)c1ccccc1OC 1P003I0G [0,2,0,0,0,0|1,0,0]=3 4995 B12R1.77 O=CC(=O)c1ccccc1OC 1P003I16 [0,2,0,0,0,0|0,0,1]=3 4996 B12R1.77 O=CC(c1ccccc1OC)C 1P028WDY [0,2,0,0,0,0|1,0,1]=4 4997 B12R1.77 OCC(=C)c1ccccc1OC 1P027Y0N [0,2,0,0,0,0|1,0,0]=3 4998 B12R1.77 OCC(=O)c1ccccc1OC 1P006YFY [0,2,0,0,0,0|0,0,0]=2 4999 B12R1.77 OCC(c1ccccc1OC)N 1P0096NE [0,2,0,0,0,0|1,0,1]=4 5000 B12R1.77 OCC(c1ccccc1OC)N 1P01AJG7 [0,2,0,0,0,0|1,0,1]=4 5001 B12R1.77 OC[C@H](c1ccccc1OC)N 1P00I6MP [0,2,0,0,0,0|1,0,1]=4 5002 B12R1.77 O\N=C(\c1ccccc1OC)/N 1P008OG1 [0,2,0,0,0,0|1,0,0]=3 5003 B12R1.87 CCc1c(Br)cccc1C(=O)O 1P003JH1 [0,2,0,0,0,0|1,0,0]=3 5004 B12R1.87 CCc1c(C)cccc1C(=O)O 1P028PEP [0,2,0,0,0,0|1,0,0]=3 5005 B12R1.87 CNc1c(F)cccc1C(=O)N 1P01A55N [0,2,0,0,0,0|2,0,0]=4 5006 B12R1.87 CNc1c(F)cccc1C(=O)O 1P000NKV [0,2,0,0,0,0|1,0,0]=3 5007 B12R1.87 CNc1c(N)cccc1C(=O)O 1P01EKLT [0,2,0,0,0,0|1,0,0]=3 5008 B12R1.87 CNc1c(N)cccc1C(=O)O 1P0291UJ [0,2,0,0,0,0|1,0,0]=3 5009 B12R1.87 COc1c(=O)ccoc1C(=O)O 1P00078X [0,2,0,0,0,0|1,0,0]=3 5010 B12R1.87 COc1c(Br)cccc1B(O)O 1P00CMYM [0,2,0,0,0,0|1,0,1]=4 5011 B12R1.87 COc1c(Br)cccc1C(=O)C 1P00BHZ8 [0,2,0,0,0,0|1,0,0]=3 5012 B12R1.87 COc1c(Br)cccc1C(=O)N 1P00IDGZ [0,2,0,0,0,0|1,0,0]=3 5013 B12R1.87 COc1c(Br)cccc1C(=O)O 1P000463 [0,2,0,0,0,0|0,0,0]=2 5014 B12R1.87 COc1c(Br)cccc1[C@@H](O)C 1P00IJAI [0,2,0,0,0,0|1,0,1]=4 5015 B12R1.87 COc1c(Br)cccc1[N+](=O)[O-] 1P003EJZ [0,2,0,0,0,0|1,0,1]=4 5016 B12R1.87 COc1c(C)cccc1B(O)O 1P0036MC [0,2,0,0,0,0|1,0,1]=4 5017 B12R1.87 COc1c(C)cccc1C(=O)C 1P00IBOE [0,2,0,0,0,0|1,0,0]=3 5018 B12R1.87 COc1c(C)cccc1C(=O)O 1P002TY6 [0,2,0,0,0,0|0,0,0]=2 5019 B12R1.87 COc1c(C)cccc1[N+](=O)[O-] 1P002338 [0,2,0,0,0,0|1,0,1]=4 5020 B12R1.87 COc1c(C)ncnc1C(=O)O 1P027L2P [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.87 COc1c(Cl)cccc1B(O)O 1P0027T9 [0,2,0,0,0,0|1,0,1]=4 5022 B12R1.87 COc1c(Cl)cccc1C(=O)C 1P006NTU [0,2,0,0,0,0|1,0,0]=3 5023 B12R1.87 COc1c(Cl)cccc1C(=O)O 1P003JNR [0,2,0,0,0,0|0,0,0]=2 5024 B12R1.87 COc1c(Cl)cccc1[N+](=O)[O-] 1P005IRT [0,2,0,0,0,0|1,0,1]=4 5025 B12R1.87 COc1c(Cl)ccnc1C(=O)O 1P00AO09 [0,2,0,0,0,0|1,0,0]=3 5026 B12R1.87 COc1c(Cl)nccc1C(=O)O 1P01JWW6 [0,2,0,0,0,0|1,0,0]=3 5027 B12R1.87 COc1c(F)cccc1B(O)O 1P005FBT [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.87 COc1c(F)cccc1C(=O)C 1P002Z8Y [0,2,0,0,0,0|1,0,0]=3 5029 B12R1.87 COc1c(F)cccc1C(=O)Cl 1P008XP9 [0,2,0,0,0,0|1,0,0]=3 5030 B12R1.87 COc1c(F)cccc1C(=O)N 1P00IF3H [0,2,0,0,0,0|1,0,0]=3 5031 B12R1.87 COc1c(F)cccc1C(=O)O 1P007D1K [0,2,0,0,0,0|0,0,0]=2 5032 B12R1.87 COc1c(F)cccc1[C@@H](O)C 1P02903P [0,2,0,0,0,0|1,0,1]=4 5033 B12R1.87 COc1c(F)cccc1[N+](=O)[O-] 1P00I98X [0,2,0,0,0,0|1,0,1]=4 5034 B12R1.87 COc1c(F)nccc1C(=O)O 1P01C7SQ [0,2,0,0,0,0|1,0,0]=3 5035 B12R1.87 COc1c(I)cccc1C(=O)O 1P01BICW [0,2,0,0,0,0|0,0,0]=2 5036 B12R1.87 COc1c(N)cccc1C(=O)N 1P01A6K7 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.87 COc1c(N)cccc1C(=O)O 1P004LDJ [0,2,0,0,0,0|0,0,0]=2 5038 B12R1.87 COc1c(N)cccc1[N+](=O)[O-] 1P00GJEL [0,2,0,0,0,0|1,0,1]=4 5039 B12R1.87 COc1c(O)cccc1B(O)O 1P01DXMW [0,2,0,0,0,0|1,0,1]=4 5040 B12R1.87 COc1c(O)cccc1[N+](=O)[O-] 1P00M4HA [0,2,0,0,0,0|1,0,1]=4 5041 B12R1.87 COc1c(O)ccnc1C(=O)O 1P01BRL5 [0,2,0,0,0,0|1,0,0]=3 5042 B12R1.87 CSc1c(Br)cccc1C(=O)O 1P01DDIW [0,2,0,0,0,0|0,1,0]=3 5043 B12R1.87 CSc1c(Cl)cccc1C(=O)O 1P01JX5E [0,2,0,0,0,0|0,1,0]=3 5044 B12R1.87 CSc1c(F)cccc1C(=O)O 1P01BI82 [0,2,0,0,0,0|0,1,0]=3 5045 B12R1.87 N#Cc1c(F)cccc1C(=O)O 1P0015EE [0,2,0,0,0,0|1,0,0]=3 5046 B12R1.87 N#Cc1c(O)cccc1C(=O)O 1P000MBS [0,2,0,0,0,0|1,0,0]=3 5047 B12R1.87 O=Cc1c(Br)cccc1C(=O)O 1P01FRMQ [0,2,0,0,0,0|0,0,1]=3 5048 B12R1.87 O=Cc1c(Cl)cccc1C(=O)O 1P007VGD [0,2,0,0,0,0|0,0,1]=3 5049 B12R1.87 O=Cc1c(Cl)nccc1C(=O)O 1P000YYN [0,2,0,0,0,0|1,0,1]=4 5050 B12R1.87 O=Cc1c(F)cccc1C(=O)O 1P01BQ33 [0,2,0,0,0,0|0,0,1]=3 5051 B12R1.87 O=Cc1c(O)cccc1C(=O)O 1P009YJ9 [0,2,0,0,0,0|0,0,1]=3 5052 B12R1.87 OCc1c(Br)cccc1[N+](=O)[O-] 1P004PJS [0,2,0,0,0,0|1,0,1]=4 5053 B12R1.87 OCc1c(C)cccc1[N+](=O)[O-] 1P00DM68 [0,2,0,0,0,0|1,0,1]=4 5054 B12R1.87 OCc1c(Cl)cccc1[N+](=O)[O-] 1P00D8JF [0,2,0,0,0,0|1,0,1]=4 5055 B12R1.87 OCc1c(F)cccc1B(O)O 1P000N0L [0,2,0,0,0,0|1,0,1]=4 5056 B12R1.87 OCc1c(F)cccc1[N+](=O)[O-] 1P001V97 [0,2,0,0,0,0|1,0,1]=4 5057 B12R1.87 OCc1c(N)cccc1[N+](=O)[O-] 1P0068SP [0,2,0,0,0,0|1,0,1]=4 5058 B12R1.261 CC(=O)c1ccccc1B(O)O 1P0031TX [0,2,0,0,0,0|1,0,0]=3 5059 B12R1.261 CC(=O)c1ccccc1C(=O)C 1P003DTZ [0,2,0,0,0,0|1,0,1]=4 5060 B12R1.261 CC(=O)c1ccccc1C(F)F 1P01DZ78 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.261 CC(=O)c1ccccc1N(C)C 1P0097HG [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.261 CC(=O)c1cccnc1C(=O)O 1P00FHGV [0,2,0,0,0,0|1,0,1]=4 5063 B12R1.261 CN(c1cccnc1C(=O)O)C 1P01C2XP [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.261 CN(c1ccncc1C(=O)O)C 1P01A75I [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.261 CN(c1cnccc1C(=O)O)C 1P028HFL [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.261 CN(c1ncccc1C(=O)O)C 1P00GW74 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.261 CN(c1ncccc1C(=O)O)C 1P00VSZF [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.261 CS(=O)c1ccccc1B(O)O 1P004PSY [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.261 CS(=O)c1ccccc1C(=O)O 1P002FEB [0,2,0,0,0,0|0,0,1]=3 5070 B12R1.261 ClC(=O)c1ccccc1C(=O)Cl 1P003U8G [0,2,0,0,0,0|1,0,1]=4 5071 B12R1.261 FC(c1cccnc1C(=O)O)F 1P00A0JO [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.261 FC(c1ccncc1C(=O)O)F 1P028MIS [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.261 FC(c1cnccc1C(=O)O)F 1P019GW3 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.261 FC(c1ncccc1C(=O)O)F 1P000OVK [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.261 NC(=O)c1ccccc1B(O)O 1P00397X [0,2,0,0,0,0|1,0,0]=3 5076 B12R1.261 NC(=O)c1ccccc1C(=O)N 1P004778 [0,2,0,0,0,0|1,0,1]=4 5077 B12R1.261 NC(=O)c1cccnc1C(=O)O 1P003JMH [0,2,0,0,0,0|1,0,1]=4 5078 B12R1.261 NC(=O)c1cnccc1C(=O)O 1P0292F6 [0,2,0,0,0,0|1,0,1]=4 5079 B12R1.261 O=[I](=O)c1ccccc1C(=O)O 1P0033TY [0,2,0,0,0,0|0,0,1]=3 5080 B12R1.261 OB(c1ccccc1B(O)O)O 1P008070 [0,2,0,0,0,0|1,0,1]=4 5081 B12R1.261 OC(=O)c1ccccc1B(O)O 1P001LUH [0,2,0,0,0,0|0,0,0]=2 5082 B12R1.261 OC(=O)c1ccccc1B(O)O 1P01QZT8 [0,2,0,0,0,0|0,0,0]=2 5083 B12R1.261 OC(=O)c1ccccc1C(=N)N 1P028BE7 [0,2,0,0,0,0|1,0,0]=3 5084 B12R1.261 OC(=O)c1ccccc1C(=O)C 1P003GS2 [0,2,0,0,0,0|0,0,1]=3 5085 B12R1.261 OC(=O)c1ccccc1C(=O)N 1P0045SR [0,2,0,0,0,0|0,0,1]=3 5086 B12R1.261 OC(=O)c1ccccc1C(=O)O 1P0035WZ [0,2,0,0,0,0|0,0,0]=2 5087 B12R1.261 OC(=O)c1ccccc1C(=O)O 1P003OD3 [0,2,0,0,0,0|0,0,0]=2 5088 B12R1.261 OC(=O)c1ccccc1C(=O)[O-] 1P0035Z7 [0,2,0,0,0,0|0,0,1]=3 5089 B12R1.261 OC(=O)c1ccccc1C(=O)[O-] 1P003U86 [0,2,0,0,0,0|0,0,1]=3 5090 B12R1.261 OC(=O)c1ccccc1C(C)C 1P00C4V3 [0,2,0,0,0,0|1,0,0]=3 5091 B12R1.261 OC(=O)c1ccccc1C(F)F 1P0054VI [0,2,0,0,0,0|1,0,0]=3 5092 B12R1.261 OC(=O)c1ccccc1C(N)C 1P00FGXP [0,2,0,0,0,0|1,0,0]=3 5093 B12R1.261 OC(=O)c1ccccc1N(C)C 1P002KQK [0,2,0,0,0,0|1,0,0]=3 5094 B12R1.261 OC(=O)c1ccccc1N(C)C 1P003FIA [0,2,0,0,0,0|1,0,0]=3 5095 B12R1.261 OC(=O)c1ccccc1[C@@H](N)C 1P024FXU [0,2,0,0,0,0|1,0,0]=3 5096 B12R1.261 OC(=O)c1cccnc1C(=O)C 1P00390Q [0,2,0,0,0,0|1,0,1]=4 5097 B12R1.261 OC(=O)c1cccnc1C(=O)C 1P027UQ0 [0,2,0,0,0,0|1,0,1]=4 5098 B12R1.261 OC(=O)c1cccnc1C(=O)N 1P00EA5D [0,2,0,0,0,0|1,0,1]=4 5099 B12R1.261 OC(=O)c1cnccc1C(=O)O 1P0033ZK [0,2,0,0,0,0|1,0,0]=3 5100 B12R1.261 OC(=O)c1cnncc1C(=O)O 1P003UIO [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.261 OC(=O)c1nccnc1C(=O)O 1P00360A [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.261 OC(=O)c1nnccc1C(=O)O 1P000ZC6 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.261 [O-]C(=O)c1ccccc1C(=O)[O-] 1P001RRJ [0,2,0,0,0,0|0,0,2]=4 5104 B12R1.261 [O-]C(=O)c1ccccc1C(=O)[O-] 1P003P51 [0,2,0,0,0,0|0,0,2]=4 5105 B12R1.261 [O-]C(=O)c1ccccc1C(=O)[O-] 1P003U85 [0,2,0,0,0,0|0,0,2]=4 5106 B12R1.261 [O-]C(=O)c1ccccc1C(O)C 1P01C3LY [0,2,0,0,0,0|0,0,1]=3 5107 B12R1.261 [O-][N+](=O)c1ccccc1B(O)O 1P003I9P [0,2,0,0,0,0|1,0,1]=4 5108 B12R1.261 [O-][N+](=O)c1ccccc1C(=O)C 1P003GQT [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.261 [O-][N+](=O)c1ccccc1C(=O)Cl 1P003I96 [0,2,0,0,0,0|1,0,1]=4 5110 B12R1.261 [O-][N+](=O)c1ccccc1C(=O)N 1P003I90 [0,2,0,0,0,0|1,0,1]=4 5111 B12R1.261 [O-][N+](=O)c1ccccc1C(=O)O 1P003I94 [0,2,0,0,0,0|0,0,1]=3 5112 B12R1.261 [O-][N+](=O)c1ccccc1C(O)C 1P003DC3 [0,2,0,0,0,0|1,0,1]=4 5113 B12R1.261 [O-][N+](=O)c1ccccc1[C@@H](O)C 1P00G3JP [0,2,0,0,0,0|1,0,1]=4 5114 B12R1.261 [O-][N+](=O)c1ccccc1[C@H](O)C 1P008SU8 [0,2,0,0,0,0|1,0,1]=4 5115 B12R1.261 [O-][N+](=O)c1cccnc1C(=O)O 1P003KAK [0,2,0,0,0,0|1,0,1]=4 5116 B12R1.261 [O-][N+](=O)c1cnccc1C(=O)O 1P003KA2 [0,2,0,0,0,0|1,0,1]=4 5117 B12R1.261 [O-][N+](=O)c1ncccc1C(=O)O 1P00BXYD [0,2,0,0,0,0|1,0,1]=4 5118 B12R1.283 C=CCc1ccccc1C(=O)O 1P00EDBY [0,2,0,0,0,0|1,0,0]=3 5119 B12R1.283 CCCc1ccccc1C(=O)O 1P00BVW9 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.283 CCCc1cccnc1C(=O)O 1P007YYC [0,2,0,0,0,0|2,0,0]=4 5121 B12R1.283 CCOc1ccccc1B(O)O 1P00I4KC [0,2,0,0,0,0|1,0,1]=4 5122 B12R1.283 CCOc1ccccc1C(=N)N 1P00I27V [0,2,0,0,0,0|2,0,0]=4 5123 B12R1.283 CCOc1ccccc1C(=O)C 1P003HMV [0,2,0,0,0,0|1,0,0]=3 5124 B12R1.283 CCOc1ccccc1C(=O)Cl 1P0033R6 [0,2,0,0,0,0|1,0,0]=3 5125 B12R1.283 CCOc1ccccc1C(=O)N 1P003HMX [0,2,0,0,0,0|1,0,0]=3 5126 B12R1.283 CCOc1ccccc1C(=O)O 1P0033R5 [0,2,0,0,0,0|0,0,0]=2 5127 B12R1.283 CCOc1ccccc1C(=S)N 1P0064AT [0,2,0,0,0,0|1,1,0]=4 5128 B12R1.283 CCOc1ccccc1C(O)C 1P01A8JH [0,2,0,0,0,0|1,0,1]=4 5129 B12R1.283 CCOc1ccccc1S(=O)[O-] 1P028EJ7 [0,2,0,0,0,0|1,0,1]=4 5130 B12R1.283 CCOc1ccccc1[C@@H](O)C 1P01AAQI [0,2,0,0,0,0|1,0,1]=4 5131 B12R1.283 CCOc1ccccc1[C@H](O)C 1P01AB64 [0,2,0,0,0,0|1,0,1]=4 5132 B12R1.283 CCOc1ccccc1[N+](=O)[O-] 1P003I9G [0,2,0,0,0,0|1,0,1]=4 5133 B12R1.283 CCOc1cccnc1C(=O)O 1P00HANZ [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.283 CCOc1cnccc1C(=O)O 1P008O4U [0,2,0,0,0,0|1,0,0]=3 5135 B12R1.283 CCOc1ncccc1C(=O)N 1P000PVR [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.283 CCOc1ncccc1C(=O)O 1P003HN7 [0,2,0,0,0,0|1,0,0]=3 5137 B12R1.283 CCSc1ccccc1C(=O)O 1P002LKN [0,2,0,0,0,0|0,1,0]=3 5138 B12R1.283 CCSc1cccnc1C(=O)O 1P01C2I4 [0,2,0,0,0,0|1,1,0]=4 5139 B12R1.283 CCSc1cnccc1C(=O)O 1P00IX43 [0,2,0,0,0,0|1,1,0]=4 5140 B12R1.283 CNCc1ccccc1C(=O)O 1P00E8J0 [0,2,0,0,0,0|1,0,0]=3 5141 B12R1.283 COCc1ccccc1B(O)O 1P0074US [0,2,0,0,0,0|1,0,1]=4 5142 B12R1.283 COCc1ccccc1C(=O)O 1P004E58 [0,2,0,0,0,0|0,0,0]=2 5143 B12R1.283 COCc1cccnc1C(=O)O 1P028DRV [0,2,0,0,0,0|1,0,0]=3 5144 B12R1.283 CSCc1cccnc1C(=O)O 1P01BD11 [0,2,0,0,0,0|1,1,0]=4 5145 B12R1.283 ClCCc1ccccc1C(=O)Cl 1P01A4V8 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.283 N#CCc1ccccc1C(=O)C 1P00EC6N [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.283 N#CCc1ccccc1C(=O)O 1P00IC1N [0,2,0,0,0,0|1,0,0]=3 5148 B12R1.283 NCCc1ccccc1C(=O)O 1P0086PW [0,2,0,0,0,0|1,0,0]=3 5149 B12R1.283 O=CNc1ccccc1C(=O)O 1P007FUJ [0,2,0,0,0,0|0,0,1]=3 5150 B12R1.283 OCCc1ccccc1B(O)O 1P00HHNX [0,2,0,0,0,0|1,0,1]=4 5151 B12R1.283 OCCc1ccccc1[N+](=O)[O-] 1P001NMN [0,2,0,0,0,0|1,0,1]=4 5152 B12R1.283 ONCc1ccccc1[N+](=O)[O-] 1P028VOM [0,2,0,0,0,0|1,0,1]=4 5153 B12R1.283 O\N=C\c1ccccc1B(O)O 1P01DU75 [0,2,0,0,0,0|1,0,1]=4 5154 B12R1.283 O\N=C\c1ccccc1N(=O)=O 1P00IMZR [0,2,0,0,0,0|1,0,1]=4 5155 B12R1.283 O\N=C\c1ccccc1[N+](=O)[O-] 1P003I8Z [0,2,0,0,0,0|1,0,1]=4 5156 B12R1.283 [N-]=[N+]=Nc1ccccc1C(=O)O 1P003H19 [0,2,0,0,0,0|1,0,0]=3 5157 B12R1.283 [N-]=[N+]=Nc1cccnc1C(=O)O 1P028PFV [0,2,0,0,0,0|2,0,0]=4 5158 B12R1.283 [N-]=[N+]=Nc1cnccc1C(=O)O 1P027R88 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.437 C=Cc1cccc(c1C(=O)O)C 1P01T4X7 [0,2,0,0,0,0|1,0,0]=3 5160 B12R1.437 CCc1cccc(c1C(=O)O)C 1P01FFPB [0,2,0,0,0,0|1,0,0]=3 5161 B12R1.437 CCc1cccc(c1C(=O)O)F 1P00DCAQ [0,2,0,0,0,0|1,0,0]=3 5162 B12R1.437 CCc1cccc(c1C(=O)O)N 1P003GZ1 [0,2,0,0,0,0|1,0,0]=3 5163 B12R1.437 COc1cc[nH]c(=O)c1C(=O)C 1P01XGHQ [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.437 COc1cc[nH]c(=O)c1C(=O)O 1P00GSYD [0,2,0,0,0,0|1,0,0]=3 5165 B12R1.437 COc1cccc(c1B(O)O)Br 1P01JKQE [0,2,0,0,0,0|1,0,1]=4 5166 B12R1.437 COc1cccc(c1B(O)O)C 1P00HYVC [0,2,0,0,0,0|1,0,1]=4 5167 B12R1.437 COc1cccc(c1B(O)O)Cl 1P0037RU [0,2,0,0,0,0|1,0,1]=4 5168 B12R1.437 COc1cccc(c1B(O)O)F 1P003HRS [0,2,0,0,0,0|1,0,1]=4 5169 B12R1.437 COc1cccc(c1C(=N)N)Cl 1P0280WU [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.437 COc1cccc(c1C(=N)N)F 1P027U1T [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.437 COc1cccc(c1C(=O)C)Br 1P00CN78 [0,2,0,0,0,0|1,0,0]=3 5172 B12R1.437 COc1cccc(c1C(=O)C)C 1P003921 [0,2,0,0,0,0|1,0,0]=3 5173 B12R1.437 COc1cccc(c1C(=O)C)Cl 1P00H1EM [0,2,0,0,0,0|1,0,0]=3 5174 B12R1.437 COc1cccc(c1C(=O)C)F 1P003HRO [0,2,0,0,0,0|1,0,0]=3 5175 B12R1.437 COc1cccc(c1C(=O)C)N 1P01BDFJ [0,2,0,0,0,0|1,0,0]=3 5176 B12R1.437 COc1cccc(c1C(=O)C)N 1P01BI30 [0,2,0,0,0,0|1,0,0]=3 5177 B12R1.437 COc1cccc(c1C(=O)C)O 1P003DBC [0,2,0,0,0,0|1,0,0]=3 5178 B12R1.437 COc1cccc(c1C(=O)C)S 1P028UYF [0,2,0,0,0,0|1,0,0]=3 5179 B12R1.437 COc1cccc(c1C(=O)N)Br 1P000SBA [0,2,0,0,0,0|1,0,0]=3 5180 B12R1.437 COc1cccc(c1C(=O)N)Cl 1P008UYU [0,2,0,0,0,0|1,0,0]=3 5181 B12R1.437 COc1cccc(c1C(=O)N)F 1P00D9BW [0,2,0,0,0,0|1,0,0]=3 5182 B12R1.437 COc1cccc(c1C(=O)N)N 1P01P139 [0,2,0,0,0,0|1,0,0]=3 5183 B12R1.437 COc1cccc(c1C(=O)O)Br 1P00C74L [0,2,0,0,0,0|0,0,0]=2 5184 B12R1.437 COc1cccc(c1C(=O)O)C 1P00E957 [0,2,0,0,0,0|0,0,0]=2 5185 B12R1.437 COc1cccc(c1C(=O)O)Cl 1P00C7FR [0,2,0,0,0,0|0,0,0]=2 5186 B12R1.437 COc1cccc(c1C(=O)O)F 1P001454 [0,2,0,0,0,0|0,0,0]=2 5187 B12R1.437 COc1cccc(c1C(=O)O)I 1P00FDQC [0,2,0,0,0,0|0,0,0]=2 5188 B12R1.437 COc1cccc(c1C(=O)O)N 1P003GZA [0,2,0,0,0,0|0,0,0]=2 5189 B12R1.437 COc1cccc(c1C(=O)O)O 1P0033TA [0,2,0,0,0,0|0,0,0]=2 5190 B12R1.437 COc1cccc(c1C(=S)N)F 1P01C1VN [0,2,0,0,0,0|1,1,0]=4 5191 B12R1.437 COc1cccc(c1[N+](=O)[O-])Br 1P006X8L [0,2,0,0,0,0|1,0,1]=4 5192 B12R1.437 COc1cccc(c1[N+](=O)[O-])C 1P003K5W [0,2,0,0,0,0|1,0,1]=4 5193 B12R1.437 COc1cccc(c1[N+](=O)[O-])Cl 1P00DK6P [0,2,0,0,0,0|1,0,1]=4 5194 B12R1.437 COc1cccc(c1[N+](=O)[O-])F 1P003386 [0,2,0,0,0,0|1,0,1]=4 5195 B12R1.437 COc1cccc(c1[N+](=O)[O-])I 1P00FIAZ [0,2,0,0,0,0|1,0,1]=4 5196 B12R1.437 COc1cccc(c1[N+](=O)[O-])N 1P001WOS [0,2,0,0,0,0|1,0,1]=4 5197 B12R1.437 COc1ccnc(c1C(=O)O)Br 1P00IF9J [0,2,0,0,0,0|1,0,0]=3 5198 B12R1.437 COc1ccnc(c1C(=O)O)Cl 1P003APD [0,2,0,0,0,0|1,0,0]=3 5199 B12R1.437 COc1ccnc(c1C(=O)O)F 1P000I55 [0,2,0,0,0,0|1,0,0]=3 5200 B12R1.437 COc1cncc(c1C(=O)C)O 1P028Y28 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.437 COc1cncc(c1C(=O)O)Br 1P01FJ4P [0,2,0,0,0,0|1,0,0]=3 5202 B12R1.437 COc1cncc(c1C(=O)O)Cl 1P00BIR5 [0,2,0,0,0,0|1,0,0]=3 5203 B12R1.437 COc1cncc(c1C(=O)O)N 1P0052UD [0,2,0,0,0,0|1,0,0]=3 5204 B12R1.437 COc1nccc(c1C(=O)C)F 1P01EKAJ [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.437 COc1nccc(c1C(=O)O)Br 1P01DYYS [0,2,0,0,0,0|1,0,0]=3 5206 B12R1.437 COc1nccc(c1C(=O)O)Cl 1P00EJFX [0,2,0,0,0,0|1,0,0]=3 5207 B12R1.437 COc1nccc(c1C(=O)O)F 1P003B57 [0,2,0,0,0,0|1,0,0]=3 5208 B12R1.437 COc1nccc(c1C(=O)O)I 1P00FHUI [0,2,0,0,0,0|1,0,0]=3 5209 B12R1.437 COc1ncnc(c1C(=O)O)C 1P01EKNM [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.437 COc1ncnc(c1C(=O)O)Cl 1P01AC2W [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.437 CSc1cccc(c1C(=O)C)O 1P028R4D [0,2,0,0,0,0|1,0,0]=3 5212 B12R1.437 CSc1cccc(c1C(=O)N)Cl 1P01A5VZ [0,2,0,0,0,0|1,1,0]=4 5213 B12R1.437 CSc1cccc(c1C(=O)O)F 1P01B8AK [0,2,0,0,0,0|0,1,0]=3 5214 B12R1.437 N#Cc1cccc(c1C(=O)O)Br 1P000S81 [0,2,0,0,0,0|1,0,0]=3 5215 B12R1.437 N#Cc1cccc(c1C(=O)O)F 1P00H1H1 [0,2,0,0,0,0|1,0,0]=3 5216 B12R1.437 N#Cc1cccc(c1C(=O)[O-])C 1P028TXP [0,2,0,0,0,0|1,0,1]=4 5217 B12R1.437 N#Cc1cccc(c1[N+](=O)[O-])O 1P000ZIU [0,2,0,0,0,0|1,0,1]=4 5218 B12R1.437 O=Cc1cccc(c1C(=O)C)F 1P02849C [0,2,0,0,0,0|1,0,1]=4 5219 B12R1.437 O=Cc1cccc(c1C(=O)O)Br 1P01DZ0W [0,2,0,0,0,0|0,0,1]=3 5220 B12R1.437 O=Cc1cccc(c1C(=O)O)C 1P01ANJ4 [0,2,0,0,0,0|0,0,1]=3 5221 B12R1.437 O=Cc1cccc(c1C(=O)O)Cl 1P002JOJ [0,2,0,0,0,0|0,0,1]=3 5222 B12R1.437 O=Cc1cccc(c1C(=O)O)F 1P01B8J2 [0,2,0,0,0,0|0,0,1]=3 5223 B12R1.437 O=Cc1cccc(c1[N+](=O)[O-])O 1P00CJB3 [0,2,0,0,0,0|1,0,1]=4 5224 B12R1.437 OCc1cccc(c1B(O)O)F 1P000N0M [0,2,0,0,0,0|1,0,1]=4 5225 B12R1.437 OCc1cccc(c1[N+](=O)[O-])Br 1P000S8I [0,2,0,0,0,0|1,0,1]=4 5226 B12R1.437 OCc1cccc(c1[N+](=O)[O-])C 1P003K5Y [0,2,0,0,0,0|1,0,1]=4 5227 B12R1.437 OCc1cccc(c1[N+](=O)[O-])Cl 1P003C8F [0,2,0,0,0,0|1,0,1]=4 5228 B12R1.437 OCc1cccc(c1[N+](=O)[O-])F 1P003JW1 [0,2,0,0,0,0|1,0,1]=4 5229 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)O 1P004AMM [0,2,0,0,0,0|2,0,0]=4 5230 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)O 1P00EEXL [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)O 1P01XD2M [0,2,0,0,0,0|2,0,0]=4 5232 B12R1.126 Cc1ccc(c(c1)O)S(=O)(=O)O 1P0004X0 [0,2,0,0,0,0|1,0,0]=3 5233 B12R1.126 Cc1ccc(c(c1)O)S(=O)(=O)O 1P00BUVI [0,2,0,0,0,0|1,0,0]=3 5234 B12R1.126 Clc1ccc(c(c1)O)S(=O)(=O)N 1P01BHZ0 [0,2,0,0,0,0|1,0,1]=4 5235 B12R1.126 Fc1ccc(c(c1)O)S(=O)(=O)Cl 1P01B8GS [0,2,0,0,0,0|1,0,1]=4 5236 B12R1.126 Nc1ccc(c(c1)C)S(=O)(=O)O 1P0011YT [0,2,0,0,0,0|2,0,0]=4 5237 B12R1.126 Nc1ccc(c(c1)N)S(=O)(=O)O 1P003BL6 [0,2,0,0,0,0|2,0,0]=4 5238 B12R1.128 Brc1ccc(c(c1)C(O)(C)C)O 1P028COR [0,2,0,0,0,0|1,0,1]=4 5239 B12R1.128 Brc1ccc(c(c1)S(=O)(=O)C)O 1P004N4X [0,2,0,0,0,0|1,0,1]=4 5240 B12R1.128 Brc1ccc(c(c1)S(=O)(=O)N)O 1P008L4T [0,2,0,0,0,0|1,0,1]=4 5241 B12R1.128 Cc1ccc(c(c1)P(=O)(O)O)Cl 1P01C1P8 [0,2,0,0,0,0|2,0,0]=4 5242 B12R1.128 Cc1ccc(c(c1)P(=O)(O)O)N 1P005JN6 [0,2,0,0,0,0|2,0,0]=4 5243 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)Cl)O 1P019WEG [0,2,0,0,0,0|1,0,1]=4 5244 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)O)C 1P00FBMV [0,2,0,0,0,0|2,0,0]=4 5245 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)O)C 1P00IB8E [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)O)N 1P003NJI [0,2,0,0,0,0|2,0,0]=4 5247 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)O)O 1P00FT38 [0,2,0,0,0,0|1,0,0]=3 5248 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)Cl)O 1P007O5A [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)F)O 1P002NI8 [0,2,0,0,0,0|1,0,1]=4 5250 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)N)O 1P00547R [0,2,0,0,0,0|1,0,1]=4 5251 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)O)Cl 1P003GDV [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)O)Cl 1P004I7A [0,2,0,0,0,0|2,0,0]=4 5253 B12R1.128 Clc1ccc(c(c1)S(=O)(=O)O)N 1P0011YU [0,2,0,0,0,0|2,0,0]=4 5254 B12R1.128 Fc1ccc(c(c1)S(=O)(=O)Cl)O 1P01B3L0 [0,2,0,0,0,0|1,0,1]=4 5255 B12R1.128 Fc1ccc(c(c1)S(=O)(=O)F)O 1P01B5UC [0,2,0,0,0,0|1,0,1]=4 5256 B12R1.128 Fc1ccc(c(c1)S(=O)(=O)N)O 1P008L4U [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.128 Nc1ccc(c(c1)S(=O)(=O)N)O 1P00H175 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.128 Nc1ccc(c(c1)S(=O)(=O)O)C 1P003MU4 [0,2,0,0,0,0|2,0,0]=4 5259 B12R1.128 Nc1ccc(c(c1)S(=O)(=O)O)Cl 1P004F8K [0,2,0,0,0,0|2,0,0]=4 5260 B12R1.128 Nc1ccc(c(c1)S(=O)(=O)O)F 1P00BXSD [0,2,0,0,0,0|2,0,0]=4 5261 B12R1.128 Nc1ccc(c(c1)S(=O)(=O)O)N 1P004E1M [0,2,0,0,0,0|2,0,0]=4 5262 B12R1.128 Oc1ccc(c(c1)S(=O)(=O)O)C 1P0006SZ [0,2,0,0,0,0|2,0,0]=4 5263 B12R1.128 Oc1ccc(c(c1)S(=O)(=O)O)O 1P002SVO [0,2,0,0,0,0|1,0,0]=3 5264 B12R1.128 Oc1ccc(c(c1)S(=O)(=O)O)O 1P008RPQ [0,2,0,0,0,0|1,0,0]=3 5265 B12R1.128 Oc1ccc(c(c1)S(=O)(=O)[O-])O 1P002DRF [0,2,0,0,0,0|1,0,1]=4 5266 B12R1.128 Oc1ccc(c(c1)S(=O)(=O)[O-])O 1P0035YR [0,2,0,0,0,0|1,0,1]=4 5267 B12R1.228 Cc1cccc(c1C)S(=O)(=O)O 1P01DWQG [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.228 Clc1cccc(c1N)S(=O)(=O)O 1P028FLY [0,2,0,0,0,0|2,0,0]=4 5269 B12R1.228 Clc1cccc(c1O)S(=O)(=O)Cl 1P01B86A [0,2,0,0,0,0|1,0,1]=4 5270 B12R1.1010 Cc1cccc(c1S(=O)(=O)O)C 1P006X52 [0,2,0,0,0,0|2,0,0]=4 5271 B12R1.1010 Cc1cccc(c1S(=O)(=O)O)O 1P00FT97 [0,2,0,0,0,0|1,0,0]=3 5272 B12R1.1010 Nc1cccc(c1S(=O)(=O)O)Cl 1P028MFE [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.1010 Nc1cccc(c1S(=O)(=O)O)O 1P00FJIJ [0,2,0,0,0,0|1,0,0]=3 5274 B12R1.894 Brc1ccc(c(c1N)C(=O)O)Br 1P01AIXC [0,2,0,0,0,0|1,0,0]=3 5275 B12R1.894 CC(=O)c1c(Br)ccc(c1F)Cl 1P01DLYS [0,2,0,0,0,0|2,0,0]=4 5276 B12R1.894 CC(=O)c1c(Br)ccc(c1F)F 1P01DTAG [0,2,0,0,0,0|2,0,0]=4 5277 B12R1.894 CC(=O)c1c(Cl)ccc(c1Cl)F 1P002XQ7 [0,2,0,0,0,0|2,0,0]=4 5278 B12R1.894 CC(=O)c1c(Cl)ccc(c1F)Br 1P01FHWC [0,2,0,0,0,0|2,0,0]=4 5279 B12R1.894 CC(=O)c1c(Cl)ccc(c1F)C 1P002SHN [0,2,0,0,0,0|2,0,0]=4 5280 B12R1.894 CC(=O)c1c(F)ccc(c1Br)C 1P01DYI2 [0,2,0,0,0,0|2,0,0]=4 5281 B12R1.894 CC(=O)c1c(F)ccc(c1Cl)Br 1P01FH8E [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.894 CC(=O)c1c(F)ccc(c1Cl)C 1P002SHO [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.894 CC(=O)c1c(F)ccc(c1F)C 1P002SJ7 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.894 CC(=O)c1c(F)ccc(c1F)Cl 1P00263Q [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.894 Cc1ccc(c(c1C)C(=O)O)C 1P01ADON [0,2,0,0,0,0|1,0,0]=3 5286 B12R1.894 Cc1ccc(c(c1N)C(=O)O)C 1P001OCM [0,2,0,0,0,0|1,0,0]=3 5287 B12R1.894 Cc1ccc(c(c1N)C(=O)O)C 1P028E8E [0,2,0,0,0,0|1,0,0]=3 5288 B12R1.894 Cc1ccc(c(c1O)C(=O)O)C 1P01DWV2 [0,2,0,0,0,0|0,0,0]=2 5289 B12R1.894 Cc1ccc(c(c1O)[N+](=O)[O-])C 1P003J7C [0,2,0,0,0,0|1,0,1]=4 5290 B12R1.894 ClC(=O)c1c(Cl)ccc(c1F)C 1P002SHJ [0,2,0,0,0,0|2,0,0]=4 5291 B12R1.894 ClC(=O)c1c(F)ccc(c1Cl)C 1P002SHK [0,2,0,0,0,0|2,0,0]=4 5292 B12R1.894 ClC(=O)c1c(F)ccc(c1F)C 1P002SIZ [0,2,0,0,0,0|2,0,0]=4 5293 B12R1.894 ClC(=O)c1c(F)ccc(c1F)Cl 1P002SGR [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.894 Clc1ccc(c(c1Br)C(=O)O)Cl 1P024F51 [0,2,0,0,0,0|1,0,0]=3 5295 B12R1.894 Clc1ccc(c(c1Cl)C(=O)O)Cl 1P006VE2 [0,2,0,0,0,0|1,0,0]=3 5296 B12R1.894 Clc1ccc(c(c1F)C(=O)O)Cl 1P00GYN1 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.894 Clc1ccc(c(c1N)C(=O)O)Cl 1P003083 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.894 Clc1ccc(c(c1O)C(=O)O)Cl 1P007IBZ [0,2,0,0,0,0|0,0,0]=2 5299 B12R1.894 Clc1ncc(c(c1Cl)C(=O)O)Cl 1P00C8PN [0,2,0,0,0,0|2,0,0]=4 5300 B12R1.894 Fc1ccc(c(c1Br)C(=O)O)F 1P009GEI [0,2,0,0,0,0|1,0,0]=3 5301 B12R1.894 Fc1ccc(c(c1C)C(=O)O)F 1P01DFGB [0,2,0,0,0,0|1,0,0]=3 5302 B12R1.894 Fc1ccc(c(c1Cl)C(=O)C)F 1P00IG1G [0,2,0,0,0,0|2,0,0]=4 5303 B12R1.894 Fc1ccc(c(c1Cl)C(=O)Cl)F 1P002SGS [0,2,0,0,0,0|2,0,0]=4 5304 B12R1.894 Fc1ccc(c(c1Cl)C(=O)N)F 1P002SGU [0,2,0,0,0,0|2,0,0]=4 5305 B12R1.894 Fc1ccc(c(c1Cl)C(=O)O)F 1P002WPA [0,2,0,0,0,0|1,0,0]=3 5306 B12R1.894 Fc1ccc(c(c1F)C(=O)C)F 1P002K0D [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.894 Fc1ccc(c(c1F)C(=O)N)F 1P002JVL [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.894 Fc1ccc(c(c1F)C(=O)O)F 1P002O7X [0,2,0,0,0,0|1,0,0]=3 5309 B12R1.894 Fc1ccc(c(c1I)C(=O)O)F 1P01EWNY [0,2,0,0,0,0|1,0,0]=3 5310 B12R1.894 Fc1ccc(c(c1N)C(=O)O)F 1P008KPH [0,2,0,0,0,0|1,0,0]=3 5311 B12R1.894 Fc1ccc(c(c1O)C(=O)O)F 1P005SMZ [0,2,0,0,0,0|0,0,0]=2 5312 B12R1.894 Fc1ccc(c(c1O)[N+](=O)[O-])F 1P001BOW [0,2,0,0,0,0|1,0,1]=4 5313 B12R1.894 Fc1ncc(c(c1F)C(=O)O)F 1P003FW3 [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.894 NC(=O)c1c(Cl)ccc(c1Cl)O 1P006WKS [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.894 NC(=O)c1c(Cl)ccc(c1F)C 1P002WFK [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.894 NC(=O)c1c(F)ccc(c1Cl)C 1P002WFL [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.894 NC(=O)c1c(F)ccc(c1F)C 1P002SJ2 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.894 NC(=O)c1c(F)ccc(c1F)Cl 1P002SGT [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.894 NC(=O)c1c(F)ccc(c1F)O 1P006Q9O [0,2,0,0,0,0|2,0,0]=4 5320 B12R1.894 NC(=O)c1c(I)ccc(c1F)Br 1P01DG1U [0,2,0,0,0,0|2,0,0]=4 5321 B12R1.894 OB(c1c(O)ccc(c1F)C)O 1P01FJ8K [0,2,0,0,0,0|1,0,1]=4 5322 B12R1.894 OC(=O)c1c(=N)[nH]cc(c1C)Br 1P00G9T7 [0,2,0,0,0,0|2,0,0]=4 5323 B12R1.894 OC(=O)c1c(Br)ccc(c1C)F 1P01DWI1 [0,2,0,0,0,0|1,0,0]=3 5324 B12R1.894 OC(=O)c1c(Br)ccc(c1C)N 1P01EDPQ [0,2,0,0,0,0|1,0,0]=3 5325 B12R1.894 OC(=O)c1c(Br)ccc(c1F)C 1P00ICZ7 [0,2,0,0,0,0|1,0,0]=3 5326 B12R1.894 OC(=O)c1c(Br)ccc(c1F)Cl 1P00HX5N [0,2,0,0,0,0|1,0,0]=3 5327 B12R1.894 OC(=O)c1c(Br)ccc(c1F)F 1P0024UV [0,2,0,0,0,0|1,0,0]=3 5328 B12R1.894 OC(=O)c1c(Br)ccc(c1F)N 1P01DVYI [0,2,0,0,0,0|1,0,0]=3 5329 B12R1.894 OC(=O)c1c(Br)ccc(c1I)F 1P028EFC [0,2,0,0,0,0|1,0,0]=3 5330 B12R1.894 OC(=O)c1c(Br)ccc(c1N)C 1P01ACEP [0,2,0,0,0,0|1,0,0]=3 5331 B12R1.894 OC(=O)c1c(Br)ccc(c1N)Cl 1P00HTLW [0,2,0,0,0,0|1,0,0]=3 5332 B12R1.894 OC(=O)c1c(Br)ccc(c1N)F 1P000GDZ [0,2,0,0,0,0|1,0,0]=3 5333 B12R1.894 OC(=O)c1c(Br)cnc(c1F)F 1P028GLQ [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.894 OC(=O)c1c(C)ccc(c1Br)F 1P01BH6U [0,2,0,0,0,0|1,0,0]=3 5335 B12R1.894 OC(=O)c1c(C)ccc(c1C)Br 1P000KQ6 [0,2,0,0,0,0|1,0,0]=3 5336 B12R1.894 OC(=O)c1c(C)ccc(c1C)N 1P01BU2B [0,2,0,0,0,0|1,0,0]=3 5337 B12R1.894 OC(=O)c1c(C)ccc(c1C)N 1P028X88 [0,2,0,0,0,0|1,0,0]=3 5338 B12R1.894 OC(=O)c1c(C)ccc(c1F)Br 1P01BULZ [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.894 OC(=O)c1c(C)ccc(c1F)Cl 1P028SSG [0,2,0,0,0,0|1,0,0]=3 5340 B12R1.894 OC(=O)c1c(C)ccc(c1F)F 1P0014G4 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.894 OC(=O)c1c(C)ccc(c1F)N 1P0284BV [0,2,0,0,0,0|1,0,0]=3 5342 B12R1.894 OC(=O)c1c(C)ccc(c1N)Br 1P0222V6 [0,2,0,0,0,0|1,0,0]=3 5343 B12R1.894 OC(=O)c1c(C)ccc(c1N)Cl 1P019Z4F [0,2,0,0,0,0|1,0,0]=3 5344 B12R1.894 OC(=O)c1c(C)ccc(c1N)F 1P0098KJ [0,2,0,0,0,0|1,0,0]=3 5345 B12R1.894 OC(=O)c1c(C)ccc(c1O)Cl 1P028NXQ [0,2,0,0,0,0|0,0,0]=2 5346 B12R1.894 OC(=O)c1c(C)ccc(c1O)F 1P028NZW [0,2,0,0,0,0|0,0,0]=2 5347 B12R1.894 OC(=O)c1c(Cl)ccc(c1C)C 1P00DLCO [0,2,0,0,0,0|1,0,0]=3 5348 B12R1.894 OC(=O)c1c(Cl)ccc(c1C)F 1P01BHQZ [0,2,0,0,0,0|1,0,0]=3 5349 B12R1.894 OC(=O)c1c(Cl)ccc(c1Cl)Br 1P00G9VX [0,2,0,0,0,0|1,0,0]=3 5350 B12R1.894 OC(=O)c1c(Cl)ccc(c1Cl)C 1P00IAVZ [0,2,0,0,0,0|1,0,0]=3 5351 B12R1.894 OC(=O)c1c(Cl)ccc(c1Cl)F 1P0026V2 [0,2,0,0,0,0|1,0,0]=3 5352 B12R1.894 OC(=O)c1c(Cl)ccc(c1F)Br 1P00FHGZ [0,2,0,0,0,0|1,0,0]=3 5353 B12R1.894 OC(=O)c1c(Cl)ccc(c1F)C 1P003NM5 [0,2,0,0,0,0|1,0,0]=3 5354 B12R1.894 OC(=O)c1c(Cl)ccc(c1F)F 1P00H2AO [0,2,0,0,0,0|1,0,0]=3 5355 B12R1.894 OC(=O)c1c(Cl)ccc(c1F)I 1P01BVUO [0,2,0,0,0,0|1,0,0]=3 5356 B12R1.894 OC(=O)c1c(Cl)ccc(c1N)Br 1P023RTD [0,2,0,0,0,0|1,0,0]=3 5357 B12R1.894 OC(=O)c1c(Cl)ccc(c1N)C 1P00IE7N [0,2,0,0,0,0|1,0,0]=3 5358 B12R1.894 OC(=O)c1c(Cl)ccc(c1N)F 1P0092VV [0,2,0,0,0,0|1,0,0]=3 5359 B12R1.894 OC(=O)c1c(Cl)ccc(c1N)O 1P01B1VL [0,2,0,0,0,0|1,0,0]=3 5360 B12R1.894 OC(=O)c1c(Cl)ccc(c1O)C 1P028YLS [0,2,0,0,0,0|0,0,0]=2 5361 B12R1.894 OC(=O)c1c(Cl)ccc(c1O)F 1P0291PU [0,2,0,0,0,0|0,0,0]=2 5362 B12R1.894 OC(=O)c1c(Cl)cnc(c1Cl)Br 1P00I79B [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.894 OC(=O)c1c(Cl)cnc(c1Cl)F 1P01ROOM [0,2,0,0,0,0|2,0,0]=4 5364 B12R1.894 OC(=O)c1c(Cl)cnc(c1F)Br 1P00DLUU [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.894 OC(=O)c1c(Cl)cnc(c1F)F 1P01KX86 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.894 OC(=O)c1c(Cl)ncc(c1C)Br 1P01C4LW [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.894 OC(=O)c1c(F)ccc(c1Br)C 1P0080TT [0,2,0,0,0,0|1,0,0]=3 5368 B12R1.894 OC(=O)c1c(F)ccc(c1Br)Cl 1P01FHQQ [0,2,0,0,0,0|1,0,0]=3 5369 B12R1.894 OC(=O)c1c(F)ccc(c1Br)I 1P01W9YU [0,2,0,0,0,0|1,0,0]=3 5370 B12R1.894 OC(=O)c1c(F)ccc(c1Br)N 1P0290B1 [0,2,0,0,0,0|1,0,0]=3 5371 B12R1.894 OC(=O)c1c(F)ccc(c1C)Br 1P0039YB [0,2,0,0,0,0|1,0,0]=3 5372 B12R1.894 OC(=O)c1c(F)ccc(c1C)Cl 1P023J8I [0,2,0,0,0,0|1,0,0]=3 5373 B12R1.894 OC(=O)c1c(F)ccc(c1Cl)Br 1P0094WE [0,2,0,0,0,0|1,0,0]=3 5374 B12R1.894 OC(=O)c1c(F)ccc(c1Cl)C 1P003BO0 [0,2,0,0,0,0|1,0,0]=3 5375 B12R1.894 OC(=O)c1c(F)ccc(c1Cl)Cl 1P003FXU [0,2,0,0,0,0|1,0,0]=3 5376 B12R1.894 OC(=O)c1c(F)ccc(c1Cl)I 1P01BVUN [0,2,0,0,0,0|1,0,0]=3 5377 B12R1.894 OC(=O)c1c(F)ccc(c1F)Br 1P00BFVN [0,2,0,0,0,0|1,0,0]=3 5378 B12R1.894 OC(=O)c1c(F)ccc(c1F)C 1P003BMB [0,2,0,0,0,0|1,0,0]=3 5379 B12R1.894 OC(=O)c1c(F)ccc(c1F)Cl 1P007OUV [0,2,0,0,0,0|1,0,0]=3 5380 B12R1.894 OC(=O)c1c(F)ccc(c1F)I 1P002LYF [0,2,0,0,0,0|1,0,0]=3 5381 B12R1.894 OC(=O)c1c(F)ccc(c1F)N 1P005A4P [0,2,0,0,0,0|1,0,0]=3 5382 B12R1.894 OC(=O)c1c(F)ccc(c1F)O 1P00G33N [0,2,0,0,0,0|1,0,0]=3 5383 B12R1.894 OC(=O)c1c(F)ccc(c1N)Br 1P01BVWU [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.894 OC(=O)c1c(F)ccc(c1N)C 1P003GZ2 [0,2,0,0,0,0|1,0,0]=3 5385 B12R1.894 OC(=O)c1c(F)ccc(c1O)Br 1P020MQ0 [0,2,0,0,0,0|0,0,0]=2 5386 B12R1.894 OC(=O)c1c(F)ccc(c1O)C 1P021Q1E [0,2,0,0,0,0|0,0,0]=2 5387 B12R1.894 OC(=O)c1c(F)ccc(c1O)Cl 1P020M25 [0,2,0,0,0,0|0,0,0]=2 5388 B12R1.894 OC(=O)c1c(F)ccc(c1O)O 1P0071JA [0,2,0,0,0,0|0,0,0]=2 5389 B12R1.894 OC(=O)c1c(F)cnc(c1C)Br 1P027UH2 [0,2,0,0,0,0|2,0,0]=4 5390 B12R1.894 OC(=O)c1c(I)ccc(c1Cl)Cl 1P022L9K [0,2,0,0,0,0|1,0,0]=3 5391 B12R1.894 OC(=O)c1c(I)ccc(c1F)Br 1P01C5NO [0,2,0,0,0,0|1,0,0]=3 5392 B12R1.894 OC(=O)c1c(I)ccc(c1F)F 1P00CJJE [0,2,0,0,0,0|1,0,0]=3 5393 B12R1.894 OC(=O)c1c(I)cnc(c1F)Cl 1P01FIYO [0,2,0,0,0,0|2,0,0]=4 5394 B12R1.894 OC(=O)c1c(I)cnc(c1F)F 1P01PQK5 [0,2,0,0,0,0|2,0,0]=4 5395 B12R1.894 OC(=O)c1c(N)ccc(c1Br)C 1P001F4V [0,2,0,0,0,0|1,0,0]=3 5396 B12R1.894 OC(=O)c1c(N)ccc(c1Br)Cl 1P00IC08 [0,2,0,0,0,0|1,0,0]=3 5397 B12R1.894 OC(=O)c1c(N)ccc(c1Br)F 1P00AO3H [0,2,0,0,0,0|1,0,0]=3 5398 B12R1.894 OC(=O)c1c(N)ccc(c1Br)I 1P01X62J [0,2,0,0,0,0|1,0,0]=3 5399 B12R1.894 OC(=O)c1c(N)ccc(c1C)Br 1P009VX3 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.894 OC(=O)c1c(N)ccc(c1C)Br 1P01AG5P [0,2,0,0,0,0|1,0,0]=3 5401 B12R1.894 OC(=O)c1c(N)ccc(c1C)F 1P01C21D [0,2,0,0,0,0|1,0,0]=3 5402 B12R1.894 OC(=O)c1c(N)ccc(c1Cl)Cl 1P002JQ4 [0,2,0,0,0,0|1,0,0]=3 5403 B12R1.894 OC(=O)c1c(N)ccc(c1Cl)F 1P00FEKI [0,2,0,0,0,0|1,0,0]=3 5404 B12R1.894 OC(=O)c1c(N)ccc(c1F)Br 1P0097FQ [0,2,0,0,0,0|1,0,0]=3 5405 B12R1.894 OC(=O)c1c(N)ccc(c1F)Br 1P01AGOO [0,2,0,0,0,0|1,0,0]=3 5406 B12R1.894 OC(=O)c1c(N)ccc(c1F)C 1P01QDLB [0,2,0,0,0,0|1,0,0]=3 5407 B12R1.894 OC(=O)c1c(N)ccc(c1F)Cl 1P00H3KB [0,2,0,0,0,0|1,0,0]=3 5408 B12R1.894 OC(=O)c1c(N)ccc(c1F)Cl 1P027VJN [0,2,0,0,0,0|1,0,0]=3 5409 B12R1.894 OC(=O)c1c(N)ccc(c1F)F 1P00DF1W [0,2,0,0,0,0|1,0,0]=3 5410 B12R1.894 OC(=O)c1c(N)ccc(c1F)F 1P0284ZU [0,2,0,0,0,0|1,0,0]=3 5411 B12R1.894 OC(=O)c1c(O)ccc(c1Br)Cl 1P01FUQE [0,2,0,0,0,0|0,0,0]=2 5412 B12R1.894 OC(=O)c1c(O)ccc(c1Br)F 1P028926 [0,2,0,0,0,0|0,0,0]=2 5413 B12R1.894 OC(=O)c1c(O)ccc(c1C)Br 1P01BPFO [0,2,0,0,0,0|0,0,0]=2 5414 B12R1.894 OC(=O)c1c(O)ccc(c1C)F 1P023QV7 [0,2,0,0,0,0|0,0,0]=2 5415 B12R1.894 OC(=O)c1c(O)ccc(c1Cl)Br 1P027BKO [0,2,0,0,0,0|0,0,0]=2 5416 B12R1.894 OC(=O)c1c(O)ccc(c1F)Br 1P023QYO [0,2,0,0,0,0|0,0,0]=2 5417 B12R1.894 OC(=O)c1c(O)ccc(c1F)Cl 1P028BPN [0,2,0,0,0,0|0,0,0]=2 5418 B12R1.894 OC(=O)c1c(O)ccc(c1F)F 1P0038WM [0,2,0,0,0,0|0,0,0]=2 5419 B12R1.894 OC(=O)c1c(O)ccc(c1O)Br 1P00BDRS [0,2,0,0,0,0|0,0,0]=2 5420 B12R1.894 OC(=O)c1c(O)ccc(c1O)Cl 1P007L75 [0,2,0,0,0,0|0,0,0]=2 5421 B12R1.894 OC(=O)c1c(O)ncc(c1C)Br 1P01C2AT [0,2,0,0,0,0|1,0,0]=3 5422 B12R1.894 OC(=O)c1c(O)nnc(c1C)C 1P018HET [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.894 [O-][N+](=O)c1c(C)ccc(c1O)Br 1P024H7K [0,2,0,0,0,0|1,0,1]=4 5424 B12R1.894 [O-][N+](=O)c1c(F)ccc(c1O)Br 1P00IEWO [0,2,0,0,0,0|1,0,1]=4 5425 B12R1.894 [O-][N+](=O)c1c(O)ccc(c1C)Br 1P0036UK [0,2,0,0,0,0|1,0,1]=4 5426 B12R1.894 [O-][N+](=O)c1c(O)ccc(c1C)Cl 1P005MXL [0,2,0,0,0,0|1,0,1]=4 5427 B12R1.894 [O-][N+](=O)c1c(O)ccc(c1F)C 1P01XAAA [0,2,0,0,0,0|1,0,1]=4 5428 B12R1.1000 Brc1cc(C)c(c(c1)Cl)C(=O)O 1P00IF7A [0,2,0,0,0,0|1,0,0]=3 5429 B12R1.1000 Brc1cc(C)c(c(c1)F)C(=O)C 1P027V6K [0,2,0,0,0,0|2,0,0]=4 5430 B12R1.1000 Brc1cc(C)c(c(c1)F)C(=O)N 1P000M5O [0,2,0,0,0,0|2,0,0]=4 5431 B12R1.1000 Brc1cc(C)c(c(c1)F)C(=O)O 1P000M5I [0,2,0,0,0,0|1,0,0]=3 5432 B12R1.1000 Brc1cc(C)c(c(c1)I)C(=O)O 1P021TPR [0,2,0,0,0,0|1,0,0]=3 5433 B12R1.1000 Brc1cc(C)c(c(c1)N)C(=O)O 1P000IOF [0,2,0,0,0,0|1,0,0]=3 5434 B12R1.1000 Brc1cc(C)c(c(c1)O)C(=O)C 1P01K14N [0,2,0,0,0,0|1,0,0]=3 5435 B12R1.1000 Brc1cc(F)c(c(c1)Br)C(=O)O 1P0024TT [0,2,0,0,0,0|1,0,0]=3 5436 B12R1.1000 Brc1cc(F)c(c(c1)Cl)C(=O)O 1P0010S6 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.1000 Brc1cc(N)c(c(c1)Br)C(=O)O 1P0055S5 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.1000 Brc1cc(N)c(c(c1)Cl)C(=O)O 1P0288SD [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.1000 Brc1cc(N)c(c(c1)F)C(=O)O 1P00HSV0 [0,2,0,0,0,0|1,0,0]=3 5440 B12R1.1000 Brc1cc(O)c(c(c1)F)C(=O)C 1P001321 [0,2,0,0,0,0|1,0,0]=3 5441 B12R1.1000 Brc1cc(O)c(c(c1)F)C(=O)O 1P0022K2 [0,2,0,0,0,0|0,0,0]=2 5442 B12R1.1000 Brc1cc(O)c(c(c1)F)[N+](=O)[O-] 1P01FHD0 [0,2,0,0,0,0|1,0,1]=4 5443 B12R1.1000 CC(=O)c1c(Br)cc(cc1Br)F 1P021G2J [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.1000 CC(=O)c1c(C)cc(cc1C)Cl 1P01EARF [0,2,0,0,0,0|2,0,0]=4 5445 B12R1.1000 CC(=O)c1c(F)cc(cc1F)Br 1P00FFT1 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.1000 CC(=O)c1c(F)cc(cc1F)Cl 1P0005X0 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.1000 CC(=O)c1c(F)cc(cc1F)F 1P003G3M [0,2,0,0,0,0|2,0,0]=4 5448 B12R1.1000 CC(=O)c1c(O)cc(cc1O)F 1P028T5N [0,2,0,0,0,0|1,0,0]=3 5449 B12R1.1000 CC(=O)c1c(O)cc(cc1O)O 1P002QCT [0,2,0,0,0,0|1,0,0]=3 5450 B12R1.1000 CC(=O)c1c(O)cc(cc1O)O 1P003G3U [0,2,0,0,0,0|1,0,0]=3 5451 B12R1.1000 Cc1c(C(=O)O)c(=O)cc([nH]1)C 1P00J2W2 [0,2,0,0,0,0|1,0,1]=4 5452 B12R1.1000 Cc1cc(C)[nH]c(=O)c1C(=O)O 1P002PGH [0,2,0,0,0,0|1,0,1]=4 5453 B12R1.1000 Cc1cc(C)c(c(c1)Br)C(=O)O 1P028T8R [0,2,0,0,0,0|1,0,0]=3 5454 B12R1.1000 Cc1cc(C)c(c(c1)C)C(=O)C 1P001XDI [0,2,0,0,0,0|2,0,0]=4 5455 B12R1.1000 Cc1cc(C)c(c(c1)F)C(=O)O 1P01B4FM [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.1000 Cc1cc(C)c(c(c1)N)C(=O)O 1P01AA7T [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.1000 Cc1cc(C)c(c(c1)O)B(O)O 1P023IZY [0,2,0,0,0,0|1,0,1]=4 5458 B12R1.1000 Cc1cc(C)c(c(c1)O)C(=O)C 1P001W3D [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.1000 Cc1cc(C)c(c(c1)O)C(=O)O 1P00EHZG [0,2,0,0,0,0|0,0,0]=2 5460 B12R1.1000 Cc1cc(C)c(c(n1)Cl)C(=O)O 1P003HDI [0,2,0,0,0,0|2,0,0]=4 5461 B12R1.1000 Cc1cc(C)c(c(n1)S)C(=O)O 1P00E4IK [0,2,0,0,0,0|1,1,0]=4 5462 B12R1.1000 Cc1cc(C)oc(=O)c1C(=O)O 1P018ST4 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.1000 Cc1cc(Cl)c(c(c1)Br)C(=O)O 1P024FH9 [0,2,0,0,0,0|1,0,0]=3 5464 B12R1.1000 Cc1cc(Cl)c(c(c1)Cl)C(=O)C 1P021GSJ [0,2,0,0,0,0|2,0,0]=4 5465 B12R1.1000 Cc1cc(Cl)c(c(n1)C)C(=O)O 1P00DDM3 [0,2,0,0,0,0|2,0,0]=4 5466 B12R1.1000 Cc1cc(F)c(c(c1)Br)C(=O)O 1P01DMOL [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.1000 Cc1cc(F)c(c(c1)Cl)C(=O)O 1P022I0Q [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.1000 Cc1cc(N)c(c(c1)F)C(=O)O 1P01B7DW [0,2,0,0,0,0|1,0,0]=3 5469 B12R1.1000 Cc1cc(O)c(c(=O)o1)C(=O)C 1P0056N3 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.1000 Cc1cc(O)c(c(c1)O)C(=O)C 1P001UJV [0,2,0,0,0,0|1,0,0]=3 5471 B12R1.1000 Cc1cc(O)c(c(n1)C)C(=O)O 1P00CMEM [0,2,0,0,0,0|1,0,0]=3 5472 B12R1.1000 Cc1cc(O)c(c(n1)O)C(=O)N 1P006MBX [0,2,0,0,0,0|2,0,0]=4 5473 B12R1.1000 ClC(=O)c1c(C)cc(cc1C)C 1P003G4D [0,2,0,0,0,0|2,0,0]=4 5474 B12R1.1000 ClC(=O)c1c(F)cc(cc1F)Br 1P00DMBZ [0,2,0,0,0,0|2,0,0]=4 5475 B12R1.1000 Clc1cc(C)c(c(c1)Cl)C(=O)O 1P00F86T [0,2,0,0,0,0|1,0,0]=3 5476 B12R1.1000 Clc1cc(C)c(c(c1)F)C(=O)O 1P01FPDY [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.1000 Clc1cc(C)c(c(c1)N)C(=O)O 1P01AC4R [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.1000 Clc1cc(C)c(c(n1)C)C(=O)O 1P00IBLB [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.1000 Clc1cc(C)c(c(n1)Cl)C(=O)O 1P0033HU [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.1000 Clc1cc(C)c(c(n1)N)C(=O)O 1P0283VB [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.1000 Clc1cc(Cl)c(c(c1)Br)C(=O)O 1P01ELNX [0,2,0,0,0,0|1,0,0]=3 5482 B12R1.1000 Clc1cc(Cl)c(c(c1)Cl)C(=O)Cl 1P003BKY [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.1000 Clc1cc(Cl)c(c(c1)I)C(=O)O 1P0281DG [0,2,0,0,0,0|1,0,0]=3 5484 B12R1.1000 Clc1cc(Cl)c(c(n1)C)C(=O)O 1P003KZV [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.1000 Clc1cc(Cl)c(c(n1)Cl)C(=O)O 1P003G3K [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.1000 Clc1cc(Cl)c(c(n1)N)C(=O)O 1P01AV3G [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.1000 Clc1cc(Cl)c(c(n1)N)C(=O)O 1P01C1P2 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.1000 Clc1cc(F)c(c(c1)Br)C(=O)O 1P01FZ2Z [0,2,0,0,0,0|1,0,0]=3 5489 B12R1.1000 Clc1cc(F)c(c(c1)Cl)C(=O)O 1P00GTWY [0,2,0,0,0,0|1,0,0]=3 5490 B12R1.1000 Clc1cc(I)c(c(n1)Cl)C(=O)O 1P01BC57 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.1000 Clc1cc(N)c(c(c1)Cl)C(=O)O 1P002JQZ [0,2,0,0,0,0|1,0,0]=3 5492 B12R1.1000 Clc1cc(N)c(c(c1)F)C(=O)N 1P01BKQR [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.1000 Clc1cc(N)c(c(c1)F)C(=O)O 1P01B6VB [0,2,0,0,0,0|1,0,0]=3 5494 B12R1.1000 Clc1cc(N)c(c(n1)C)C(=O)O 1P01XCZV [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.1000 Clc1cc(N)c(c(n1)Cl)C(=O)O 1P00H1IC [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.1000 Clc1cc(N)c(c(n1)Cl)C(=O)O 1P01XBUJ [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.1000 Clc1cc(O)c(c(c1)Cl)B(O)O 1P009574 [0,2,0,0,0,0|1,0,1]=4 5498 B12R1.1000 Clc1cc(O)c(c(c1)Cl)C(=O)O 1P019XWD [0,2,0,0,0,0|0,0,0]=2 5499 B12R1.1000 Clc1cc(O)c(c(c1)F)C(=O)C 1P007C0P [0,2,0,0,0,0|1,0,0]=3 5500 B12R1.1000 Clc1cc(O)c(c(c1)F)C(=O)O 1P028APQ [0,2,0,0,0,0|0,0,0]=2 5501 B12R1.1000 Fc1cc(C)c(c(c1)Br)C(=O)O 1P00028O [0,2,0,0,0,0|1,0,0]=3 5502 B12R1.1000 Fc1cc(C)c(c(c1)Cl)C(=O)O 1P00LJ08 [0,2,0,0,0,0|1,0,0]=3 5503 B12R1.1000 Fc1cc(Cl)c(c(c1)Br)C(=O)O 1P01APLC [0,2,0,0,0,0|1,0,0]=3 5504 B12R1.1000 Fc1cc(F)c(c(c1)Br)C(=O)O 1P00390X [0,2,0,0,0,0|1,0,0]=3 5505 B12R1.1000 Fc1cc(F)c(c(c1)Cl)C(=O)O 1P000M7M [0,2,0,0,0,0|1,0,0]=3 5506 B12R1.1000 Fc1cc(F)c(c(n1)F)C(=O)O 1P01BGJ1 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.1000 Fc1cc(N)c(c(c1)Br)C(=O)O 1P023QV1 [0,2,0,0,0,0|1,0,0]=3 5508 B12R1.1000 Fc1cc(N)c(c(c1)Cl)C(=O)O 1P01BGX0 [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.1000 Fc1cc(N)c(c(c1)F)C(=O)C 1P001UCP [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.1000 Fc1cc(N)c(c(c1)F)C(=O)O 1P000TJU [0,2,0,0,0,0|1,0,0]=3 5511 B12R1.1000 Fc1cc(O)c(c(c1)Br)[N+](=O)[O-] 1P01FHST [0,2,0,0,0,0|1,0,1]=4 5512 B12R1.1000 Fc1cc(O)c(c(c1)F)C(=O)C 1P019UK8 [0,2,0,0,0,0|1,0,0]=3 5513 B12R1.1000 Fc1cc(O)c(c(c1)F)C(=O)O 1P002INO [0,2,0,0,0,0|0,0,0]=2 5514 B12R1.1000 Fc1cc(O)c(c(c1)F)[N+](=O)[O-] 1P001NRT [0,2,0,0,0,0|1,0,1]=4 5515 B12R1.1000 NC(=O)c1c(Cl)cc(cc1Cl)F 1P01BF0G [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.1000 NC(=O)c1c(F)cc(cc1F)Br 1P00G7CY [0,2,0,0,0,0|2,0,0]=4 5517 B12R1.1000 NC(=O)c1c(F)cc(cc1F)F 1P004ZB0 [0,2,0,0,0,0|2,0,0]=4 5518 B12R1.1000 Nc1cc(C)c(c(n1)C)C(=O)O 1P01C86H [0,2,0,0,0,0|2,0,0]=4 5519 B12R1.1000 O=c1cc(C)c(c([nH]1)C)C(=O)O 1P00J31K [0,2,0,0,0,0|2,0,0]=4 5520 B12R1.1000 O=c1cc(C)c(c(o1)C)C(=O)O 1P003RKG [0,2,0,0,0,0|2,0,0]=4 5521 B12R1.1000 O=c1cc(O)c(c(o1)C)C(=O)C 1P002E1E [0,2,0,0,0,0|2,0,0]=4 5522 B12R1.1000 OC(=O)c1c(Br)cc(cc1Br)Br 1P003G38 [0,2,0,0,0,0|1,0,0]=3 5523 B12R1.1000 OC(=O)c1c(C)cc(cc1C)Br 1P00FB9G [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.1000 OC(=O)c1c(C)cc(cc1C)C 1P00395Z [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.1000 OC(=O)c1c(C)cc(cc1C)Cl 1P00CS1E [0,2,0,0,0,0|1,0,0]=3 5526 B12R1.1000 OC(=O)c1c(C)cc(cc1C)F 1P001X3T [0,2,0,0,0,0|1,0,0]=3 5527 B12R1.1000 OC(=O)c1c(C)cc(cc1C)N 1P001XW5 [0,2,0,0,0,0|1,0,0]=3 5528 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)Br 1P002N16 [0,2,0,0,0,0|1,0,0]=3 5529 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)C 1P019GFD [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)Cl 1P006UAJ [0,2,0,0,0,0|1,0,0]=3 5531 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)F 1P002N15 [0,2,0,0,0,0|1,0,0]=3 5532 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)I 1P000P9E [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.1000 OC(=O)c1c(Cl)cc(cc1Cl)N 1P00DBWF [0,2,0,0,0,0|1,0,0]=3 5534 B12R1.1000 OC(=O)c1c(F)cc(cc1F)Br 1P0024TU [0,2,0,0,0,0|1,0,0]=3 5535 B12R1.1000 OC(=O)c1c(F)cc(cc1F)C 1P000QVH [0,2,0,0,0,0|1,0,0]=3 5536 B12R1.1000 OC(=O)c1c(F)cc(cc1F)Cl 1P003LJF [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.1000 OC(=O)c1c(F)cc(cc1F)F 1P0033F9 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.1000 OC(=O)c1c(F)cc(cc1F)I 1P00HE5F [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.1000 OC(=O)c1c(F)cc(cc1F)N 1P003A5X [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.1000 OC(=O)c1c(F)cc(cc1F)S 1P02929Y [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.1000 OC(=O)c1c(O)cc(cc1O)C 1P0033ID [0,2,0,0,0,0|0,0,0]=2 5542 B12R1.1000 Oc1cc(Br)c(c(c1)Br)C(=O)O 1P024G9Y [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.1000 Oc1cc(C)c(c(c1)C)C(=O)O 1P005F3Z [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.1000 Oc1cc(C)c(c(c1)O)C(=O)O 1P003G9S [0,2,0,0,0,0|0,0,0]=2 5545 B12R1.1000 Oc1cc(Cl)c(c(c1)Cl)C(=O)O 1P00DBVA [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.1000 Oc1cc(F)c(c(c1)Br)C(=O)O 1P00PKVC [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.1000 Oc1cc(F)c(c(c1)F)C(=O)O 1P00BD0M [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.1000 Oc1cc(O)c(c(c1)O)C(=O)O 1P003G3V [0,2,0,0,0,0|0,0,0]=2 5549 B12R1.1000 Oc1cc(O)c(c(c1)O)C(=O)O 1P003G3W [0,2,0,0,0,0|0,0,0]=2 5550 B12R1.1000 Oc1cc(O)cc(c1[N+](=O)[O-])O 1P003I9S [0,2,0,0,0,0|1,0,1]=4 5551 B12R1.1000 [O-]C(=O)c1c(O)cc(cc1O)N 1P028R7B [0,2,0,0,0,0|0,0,1]=3 5552 B12R1.3441 BrCC(=O)c1c(C)cccc1C 1P021OIQ [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.3441 BrCC(=O)c1c(Cl)cccc1Br 1P01JKSM [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.3441 BrCC(=O)c1c(Cl)cccc1Cl 1P008MKA [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.3441 BrCC(=O)c1c(F)cccc1Br 1P027B2B [0,2,0,0,0,0|2,0,0]=4 5556 B12R1.3441 BrCC(=O)c1c(F)cccc1Cl 1P001PW0 [0,2,0,0,0,0|2,0,0]=4 5557 B12R1.3441 BrCC(=O)c1c(F)cccc1F 1P00DADM [0,2,0,0,0,0|2,0,0]=4 5558 B12R1.3441 C=CC(=O)c1c(Cl)cccc1Cl 1P028VN2 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.3441 C=CC(=O)c1c(F)cccc1Cl 1P0293JA [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.3441 CCC(=O)c1c(Cl)cccc1Cl 1P019Z35 [0,2,0,0,0,0|2,0,0]=4 5561 B12R1.3441 CCC(=O)c1c(F)cccc1Cl 1P01A1IL [0,2,0,0,0,0|2,0,0]=4 5562 B12R1.3441 CCC(=O)c1c(F)cccc1F 1P0033IC [0,2,0,0,0,0|2,0,0]=4 5563 B12R1.3441 CCC(=O)c1c(O)cccc1Cl 1P027UCE [0,2,0,0,0,0|1,0,0]=3 5564 B12R1.3441 CNC(=O)c1c(C)cccc1N 1P01A9Z5 [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.3441 CNC(=O)c1c(Cl)cccc1Cl 1P01EW3O [0,2,0,0,0,0|2,0,0]=4 5566 B12R1.3441 CNC(=O)c1c(F)cccc1Br 1P01DZ8F [0,2,0,0,0,0|2,0,0]=4 5567 B12R1.3441 CNC(=O)c1c(F)cccc1F 1P007PHI [0,2,0,0,0,0|2,0,0]=4 5568 B12R1.3441 COC(=O)c1c(Br)cccc1Br 1P00H3PF [0,2,0,0,0,0|1,0,0]=3 5569 B12R1.3441 COC(=O)c1c(Br)cccc1I 1P00HJMT [0,2,0,0,0,0|1,0,0]=3 5570 B12R1.3441 COC(=O)c1c(Br)ccnc1Cl 1P00HBA1 [0,2,0,0,0,0|2,0,0]=4 5571 B12R1.3441 COC(=O)c1c(Br)cncc1Br 1P00HGO4 [0,2,0,0,0,0|2,0,0]=4 5572 B12R1.3441 COC(=O)c1c(C)cc[nH]c1=O 1P00AR94 [0,2,0,0,0,0|1,0,1]=4 5573 B12R1.3441 COC(=O)c1c(C)cccc1Br 1P006O3L [0,2,0,0,0,0|1,0,0]=3 5574 B12R1.3441 COC(=O)c1c(C)cccc1C 1P001LXJ [0,2,0,0,0,0|1,0,0]=3 5575 B12R1.3441 COC(=O)c1c(C)cccc1Cl 1P0065DC [0,2,0,0,0,0|1,0,0]=3 5576 B12R1.3441 COC(=O)c1c(C)cccc1F 1P002BBH [0,2,0,0,0,0|1,0,0]=3 5577 B12R1.3441 COC(=O)c1c(C)cccc1I 1P008ZOJ [0,2,0,0,0,0|1,0,0]=3 5578 B12R1.3441 COC(=O)c1c(C)cccc1N 1P00AMGC [0,2,0,0,0,0|1,0,0]=3 5579 B12R1.3441 COC(=O)c1c(C)cccc1O 1P007FFP [0,2,0,0,0,0|0,0,0]=2 5580 B12R1.3441 COC(=O)c1c(C)ccnc1Cl 1P00BJ4C [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.3441 COC(=O)c1c(C)ccnc1N 1P0056JS [0,2,0,0,0,0|2,0,0]=4 5582 B12R1.3441 COC(=O)c1c(C)ncnc1O 1P0287P4 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.3441 COC(=O)c1c(Cl)cccc1Br 1P00FCTV [0,2,0,0,0,0|1,0,0]=3 5584 B12R1.3441 COC(=O)c1c(Cl)cccc1Cl 1P001LXI [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.3441 COC(=O)c1c(Cl)cccc1I 1P00HJGH [0,2,0,0,0,0|1,0,0]=3 5586 B12R1.3441 COC(=O)c1c(Cl)ccnc1Br 1P01XD31 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.3441 COC(=O)c1c(Cl)ccnc1C 1P000S9B [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.3441 COC(=O)c1c(Cl)ccnc1Cl 1P003S2C [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.3441 COC(=O)c1c(Cl)cncc1Br 1P020KZA [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.3441 COC(=O)c1c(F)cccc1Br 1P004YOZ [0,2,0,0,0,0|1,0,0]=3 5591 B12R1.3441 COC(=O)c1c(F)cccc1Cl 1P001NRB [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.3441 COC(=O)c1c(F)cccc1F 1P0012QC [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.3441 COC(=O)c1c(F)cccc1I 1P001E38 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.3441 COC(=O)c1c(F)ccnc1Br 1P028A8X [0,2,0,0,0,0|2,0,0]=4 5595 B12R1.3441 COC(=O)c1c(F)ccnc1Cl 1P0022KF [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.3441 COC(=O)c1c(F)ccnc1F 1P0022MS [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.3441 COC(=O)c1c(F)cncc1Br 1P00158M [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.3441 COC(=O)c1c(I)ccnc1Cl 1P003S3Z [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.3441 COC(=O)c1c(I)ccnc1F 1P004F30 [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.3441 COC(=O)c1c(I)ccnc1N 1P00I1NA [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.3441 COC(=O)c1c(N)cccc1Br 1P00389W [0,2,0,0,0,0|1,0,0]=3 5602 B12R1.3441 COC(=O)c1c(N)cccc1Cl 1P001SZ5 [0,2,0,0,0,0|1,0,0]=3 5603 B12R1.3441 COC(=O)c1c(N)cccc1Cl 1P00CJ96 [0,2,0,0,0,0|1,0,0]=3 5604 B12R1.3441 COC(=O)c1c(N)cccc1F 1P0036UG [0,2,0,0,0,0|1,0,0]=3 5605 B12R1.3441 COC(=O)c1c(N)cccc1I 1P028HYB [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.3441 COC(=O)c1c(N)cccc1O 1P00EIUF [0,2,0,0,0,0|0,0,0]=2 5607 B12R1.3441 COC(=O)c1c(N)ccnc1Cl 1P00068U [0,2,0,0,0,0|2,0,0]=4 5608 B12R1.3441 COC(=O)c1c(O)cccc1Cl 1P00AOFE [0,2,0,0,0,0|0,0,0]=2 5609 B12R1.3441 COC(=O)c1c(O)cccc1F 1P005UGP [0,2,0,0,0,0|0,0,0]=2 5610 B12R1.3441 COC(=O)c1c(O)cccc1O 1P0035MC [0,2,0,0,0,0|0,0,0]=2 5611 B12R1.3441 NCC(=O)c1c(Cl)cccc1Cl 1P01B346 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.3441 NCC(=O)c1c(F)cccc1Cl 1P01C4FJ [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.3441 NCC(=O)c1c(F)cccc1F 1P00JT3M [0,2,0,0,0,0|2,0,0]=4 5614 B12R1.3441 NNC(=O)c1c(C)cccc1O 1P027WRX [0,2,0,0,0,0|1,0,0]=3 5615 B12R1.3441 NNC(=O)c1c(Cl)cccc1Cl 1P01AAOT [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.3441 NNC(=O)c1c(F)cccc1Cl 1P0046PP [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.3441 NNC(=O)c1c(F)cccc1Cl 1P027VE1 [0,2,0,0,0,0|2,0,0]=4 5618 B12R1.3441 NNC(=O)c1c(F)cccc1F 1P0033I7 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.3441 OCC(=O)c1c(F)cccc1F 1P01BTWK [0,2,0,0,0,0|1,0,0]=3 5620 B12R1.3441 ONC(=N)c1c(Cl)cccc1Cl 1P002NX4 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.3441 ONC(=N)c1c(F)cccc1Cl 1P001V93 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.3441 ONC(=O)c1c(F)cccc1Cl 1P01AB6H [0,2,0,0,0,0|1,0,0]=3 5623 B12R1.3441 O\N=C(\c1c(Cl)cccc1Cl)/Cl 1P00FCEG [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.24 BrCC(=O)c1cccc(c1F)Br 1P00HFXE [0,2,0,0,0,0|2,0,0]=4 5625 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1P00C1KK [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1P01ACEL [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.24 CCC(=O)c1cccc(c1F)F 1P002OKX [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.24 CCC(=O)c1cccc(c1I)F 1P00A0IF [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.24 CCC(=O)c1cccc(c1N)N 1P01BSE8 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1P00H902 [0,2,0,0,0,0|1,0,0]=3 5631 B12R1.24 CCC(=O)c1cccc(c1O)F 1P01BB94 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.24 CNC(=O)c1cccc(c1Br)N 1P01BBDE [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.24 CNC(=O)c1cccc(c1F)Br 1P01DVJT [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.24 CNC(=O)c1cccc(c1N)C 1P004LSB [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.24 CNC(=O)c1cccc(c1N)Cl 1P00281S [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.24 CNC(=O)c1cccc(c1N)F 1P0005ZQ [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.24 CNC(=O)c1cccc(c1O)O 1P005CXC [0,2,0,0,0,0|1,0,0]=3 5638 B12R1.24 COC(=O)c1cccc(c1Br)C 1P000VSC [0,2,0,0,0,0|1,0,0]=3 5639 B12R1.24 COC(=O)c1cccc(c1Br)Cl 1P00HC88 [0,2,0,0,0,0|1,0,0]=3 5640 B12R1.24 COC(=O)c1cccc(c1Br)F 1P00EM5W [0,2,0,0,0,0|1,0,0]=3 5641 B12R1.24 COC(=O)c1cccc(c1Br)I 1P000SHZ [0,2,0,0,0,0|1,0,0]=3 5642 B12R1.24 COC(=O)c1cccc(c1Br)N 1P007U7I [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.24 COC(=O)c1cccc(c1Br)O 1P01PQQZ [0,2,0,0,0,0|1,0,0]=3 5644 B12R1.24 COC(=O)c1cccc(c1C)C 1P001MTL [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.24 COC(=O)c1cccc(c1Cl)Br 1P00IETY [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.24 COC(=O)c1cccc(c1Cl)C 1P006LFG [0,2,0,0,0,0|1,0,0]=3 5647 B12R1.24 COC(=O)c1cccc(c1Cl)Cl 1P002VSP [0,2,0,0,0,0|1,0,0]=3 5648 B12R1.24 COC(=O)c1cccc(c1Cl)F 1P00F9XW [0,2,0,0,0,0|1,0,0]=3 5649 B12R1.24 COC(=O)c1cccc(c1Cl)I 1P00KIRV [0,2,0,0,0,0|1,0,0]=3 5650 B12R1.24 COC(=O)c1cccc(c1Cl)N 1P000QS8 [0,2,0,0,0,0|1,0,0]=3 5651 B12R1.24 COC(=O)c1cccc(c1Cl)N 1P01AM40 [0,2,0,0,0,0|1,0,0]=3 5652 B12R1.24 COC(=O)c1cccc(c1Cl)O 1P008UAK [0,2,0,0,0,0|1,0,0]=3 5653 B12R1.24 COC(=O)c1cccc(c1F)Br 1P002J0C [0,2,0,0,0,0|1,0,0]=3 5654 B12R1.24 COC(=O)c1cccc(c1F)C 1P00EIUG [0,2,0,0,0,0|1,0,0]=3 5655 B12R1.24 COC(=O)c1cccc(c1F)Cl 1P005C11 [0,2,0,0,0,0|1,0,0]=3 5656 B12R1.24 COC(=O)c1cccc(c1F)F 1P002854 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.24 COC(=O)c1cccc(c1F)I 1P00HJBM [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.24 COC(=O)c1cccc(c1F)N 1P000JFD [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.24 COC(=O)c1cccc(c1F)O 1P00158P [0,2,0,0,0,0|1,0,0]=3 5660 B12R1.24 COC(=O)c1cccc(c1I)Br 1P0016DZ [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.24 COC(=O)c1cccc(c1I)C 1P00944B [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.24 COC(=O)c1cccc(c1I)F 1P00I87P [0,2,0,0,0,0|1,0,0]=3 5663 B12R1.24 COC(=O)c1cccc(c1I)N 1P00I5S3 [0,2,0,0,0,0|1,0,0]=3 5664 B12R1.24 COC(=O)c1cccc(c1N)Br 1P0036IK [0,2,0,0,0,0|1,0,0]=3 5665 B12R1.24 COC(=O)c1cccc(c1N)C 1P0035MD [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.24 COC(=O)c1cccc(c1N)Cl 1P003S34 [0,2,0,0,0,0|1,0,0]=3 5667 B12R1.24 COC(=O)c1cccc(c1N)F 1P00ABHA [0,2,0,0,0,0|1,0,0]=3 5668 B12R1.24 COC(=O)c1cccc(c1N)I 1P00I0HD [0,2,0,0,0,0|1,0,0]=3 5669 B12R1.24 COC(=O)c1cccc(c1N)N 1P0035M9 [0,2,0,0,0,0|1,0,0]=3 5670 B12R1.24 COC(=O)c1cccc(c1N)O 1P0025BV [0,2,0,0,0,0|1,0,0]=3 5671 B12R1.24 COC(=O)c1cccc(c1N)O 1P01C3P3 [0,2,0,0,0,0|1,0,0]=3 5672 B12R1.24 COC(=O)c1cccc(c1O)Br 1P00BFR1 [0,2,0,0,0,0|0,0,0]=2 5673 B12R1.24 COC(=O)c1cccc(c1O)C 1P002N81 [0,2,0,0,0,0|0,0,0]=2 5674 B12R1.24 COC(=O)c1cccc(c1O)Cl 1P00DK4C [0,2,0,0,0,0|0,0,0]=2 5675 B12R1.24 COC(=O)c1cccc(c1O)F 1P005L8P [0,2,0,0,0,0|0,0,0]=2 5676 B12R1.24 COC(=O)c1cccc(c1O)N 1P00C7E7 [0,2,0,0,0,0|0,0,0]=2 5677 B12R1.24 COC(=O)c1cccc(c1S)F 1P0289QQ [0,2,0,0,0,0|0,1,0]=3 5678 B12R1.24 COC(=O)c1cccn(c1=O)C 1P00IC62 [0,2,0,0,0,0|1,0,1]=4 5679 B12R1.24 COC(=O)c1ccnc(c1Br)Cl 1P01U2M2 [0,2,0,0,0,0|2,0,0]=4 5680 B12R1.24 COC(=O)c1ccnc(c1Br)F 1P01AM1E [0,2,0,0,0,0|2,0,0]=4 5681 B12R1.24 COC(=O)c1ccnc(c1C)C 1P000O5M [0,2,0,0,0,0|2,0,0]=4 5682 B12R1.24 COC(=O)c1ccnc(c1Cl)Br 1P023RRK [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.24 COC(=O)c1ccnc(c1Cl)Cl 1P00EEOD [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.24 COC(=O)c1ccnc(c1F)Br 1P0015G7 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.24 COC(=O)c1ccnc(c1F)Cl 1P0037KG [0,2,0,0,0,0|2,0,0]=4 5686 B12R1.24 COC(=O)c1ccnc(c1F)F 1P00HUHY [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.24 COC(=O)c1ccnc(c1I)F 1P027WL3 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.24 COC(=O)c1ccnc(c1N)C 1P000JTL [0,2,0,0,0,0|2,0,0]=4 5689 B12R1.24 COC(=O)c1ccnc(c1N)Cl 1P001ZD8 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.24 COC(=O)c1ccnc(c1N)F 1P024ULR [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.24 COC(=O)c1ccnc(c1N)N 1P01BABW [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.24 COC(=O)c1ccnc(c1N)O 1P01BEO7 [0,2,0,0,0,0|2,0,0]=4 5693 B12R1.24 COC(=O)c1ccnc(c1O)Cl 1P00AMHZ [0,2,0,0,0,0|1,0,0]=3 5694 B12R1.24 COC(=O)c1cncc(c1Cl)Br 1P000OVM [0,2,0,0,0,0|2,0,0]=4 5695 B12R1.24 COC(=O)c1cncc(c1N)Br 1P01KZLH [0,2,0,0,0,0|2,0,0]=4 5696 B12R1.24 COC(=O)c1cncc(c1N)F 1P0276K8 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.24 COC(=O)c1cncc(c1O)Br 1P0093EZ [0,2,0,0,0,0|1,0,0]=3 5698 B12R1.24 COC(=O)c1nccc(c1Cl)Cl 1P00I79A [0,2,0,0,0,0|2,0,0]=4 5699 B12R1.24 COC(=O)c1nccc(c1F)C 1P027N2M [0,2,0,0,0,0|2,0,0]=4 5700 B12R1.24 COC(=O)c1nccc(c1F)Cl 1P0095WL [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.24 COC(=O)c1nccc(c1O)Br 1P01C70V [0,2,0,0,0,0|1,0,0]=3 5702 B12R1.24 COC(=O)c1nccc(c1O)Cl 1P01AD2G [0,2,0,0,0,0|1,0,0]=3 5703 B12R1.24 Cc1c(cccc1Br)C(=O)NN 1P008VPB [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.24 Cc1c(cccc1Br)C(=O)OC 1P003S82 [0,2,0,0,0,0|1,0,0]=3 5705 B12R1.24 Cc1c(cccc1C)C(=O)NN 1P007P0A [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.24 Cc1c(cccc1Cl)C(=O)CBr 1P028BYL [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.24 Cc1c(cccc1Cl)C(=O)OC 1P0065D8 [0,2,0,0,0,0|1,0,0]=3 5708 B12R1.24 Cc1c(cccc1F)C(=O)C=C 1P024SFI [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.24 Cc1c(cccc1F)C(=O)OC 1P002ME4 [0,2,0,0,0,0|1,0,0]=3 5710 B12R1.24 Cc1c(cccc1I)C(=O)OC 1P00DAUI [0,2,0,0,0,0|1,0,0]=3 5711 B12R1.24 Cc1c(cccc1N)C(=O)NC 1P00GW11 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.24 Cc1c(cccc1N)C(=O)OC 1P003S7K [0,2,0,0,0,0|1,0,0]=3 5713 B12R1.24 Cc1c(cccc1O)C(=O)OC 1P00DLC8 [0,2,0,0,0,0|1,0,0]=3 5714 B12R1.24 Cc1c(ccnc1Br)C(=O)OC 1P01DDH8 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.24 Cc1c(ccnc1Cl)C(=O)OC 1P003S3X [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.24 Cc1c(ccnc1N)C(=O)OC 1P01B6SO [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.24 Cc1c(cncc1Br)C(=O)OC 1P0018WS [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.24 Cc1c(cncc1N)C(=O)OC 1P028N11 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.24 Cc1c(nccc1Br)C(=O)OC 1P009YQ2 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.24 Cc1c(nccc1Cl)C(=O)OC 1P000RNJ [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.24 Cc1c(nccc1N)C(=O)OC 1P0289T1 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.24 Cc1c(nccc1N)C(=O)OC 1P028JIX [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.24 Cc1cccc(c1N)C(=O)NN 1P027VZ9 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.24 Cc1cccc(c1O)C(=O)CBr 1P028F6R [0,2,0,0,0,0|1,0,0]=3 5725 B12R1.24 Cc1cccc(c1O)C(=O)NN 1P0032B8 [0,2,0,0,0,0|1,0,0]=3 5726 B12R1.24 Cc1cccc(c1O)C(=O)NO 1P01AKEB [0,2,0,0,0,0|0,0,0]=2 5727 B12R1.24 ClCC(=O)c1cccc(c1Br)Cl 1P028DG1 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.24 Clc1c(cccc1Cl)C(=O)C#N 1P003712 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.24 Clc1c(cccc1Cl)C(=O)CBr 1P01B9R4 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.24 Cn1c(cccc1=O)C(=O)OC 1P002K62 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.24 Fc1c(cccc1Cl)C(=O)CBr 1P000IVV [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.24 Fc1cccc(c1Cl)C(=O)CBr 1P027B2S [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.24 NC(c1cccc(c1O)Br)CO 1P024HFJ [0,2,0,0,0,0|1,0,1]=4 5734 B12R1.24 NCC(=O)c1cccc(c1Cl)Cl 1P009O33 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.24 NCC(=O)c1cccc(c1Cl)F 1P01BXWH [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.24 NCC(=O)c1cccc(c1F)F 1P01C0Q6 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.24 NNC(=O)c1cccc(c1C)N 1P0284A9 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.24 NNC(=O)c1cccc(c1Cl)Cl 1P00DD8O [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.24 NNC(=O)c1cccc(c1F)Br 1P01SL41 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.24 ONC(=N)c1cccc(c1Cl)Cl 1P002SH0 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.24 Oc1c(cccc1O)C(=O)CCl 1P003B2D [0,2,0,0,0,0|1,0,0]=3 5742 B12R1.24 [O-]c1cncc(c1Cl)C(=O)OC 1P0201W0 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.440 BrCc1cccc(c1Cl)C(=O)O 1P003Z5Y [0,2,0,0,0,0|1,0,0]=3 5744 B12R1.440 BrCc1cccc(c1F)C(=O)O 1P005O0S [0,2,0,0,0,0|1,0,0]=3 5745 B12R1.440 C#Cc1cccc(c1C)C(=O)O 1P0285JW [0,2,0,0,0,0|1,0,0]=3 5746 B12R1.440 C#Cc1cccc(c1Cl)C(=O)O 1P028D88 [0,2,0,0,0,0|1,0,0]=3 5747 B12R1.440 C#Cc1cccc(c1F)C(=O)C 1P027Y7U [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.440 C#Cc1cccc(c1F)C(=O)O 1P0291A8 [0,2,0,0,0,0|1,0,0]=3 5749 B12R1.440 CCc1cccc(c1C)C(=O)O 1P027YSG [0,2,0,0,0,0|1,0,0]=3 5750 B12R1.440 CCc1cccc(c1F)C(=O)O 1P028RTW [0,2,0,0,0,0|1,0,0]=3 5751 B12R1.440 CCc1cccc(c1N)C(=O)O 1P01A9HJ [0,2,0,0,0,0|1,0,0]=3 5752 B12R1.440 CCc1cccc(c1N)C(=O)O 1P01BE1M [0,2,0,0,0,0|1,0,0]=3 5753 B12R1.440 CCc1cccc(c1O)C(=O)O 1P019VPP [0,2,0,0,0,0|0,0,0]=2 5754 B12R1.440 CNc1nccc(c1N)C(=O)O 1P01BB1W [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.440 COc1cccc(c1Br)C(=O)C 1P021WEZ [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.440 COc1cccc(c1Br)C(=O)O 1P004MQG [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.440 COc1cccc(c1C)C(=O)O 1P00347F [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.440 COc1cccc(c1Cl)C(=O)C 1P01C2IV [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.440 COc1cccc(c1Cl)C(=O)O 1P003HCG [0,2,0,0,0,0|1,0,0]=3 5760 B12R1.440 COc1cccc(c1F)C(=O)C 1P00BHRP [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.440 COc1cccc(c1F)C(=O)O 1P001455 [0,2,0,0,0,0|1,0,0]=3 5762 B12R1.440 COc1cccc(c1N)C(=O)C 1P00CM2F [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.440 COc1cccc(c1N)C(=O)N 1P008XLH [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.440 COc1cccc(c1N)C(=O)O 1P0033JO [0,2,0,0,0,0|1,0,0]=3 5765 B12R1.440 COc1cccc(c1O)B(O)O 1P002RIJ [0,2,0,0,0,0|1,0,1]=4 5766 B12R1.440 COc1cccc(c1O)C(=O)C 1P005JZM [0,2,0,0,0,0|1,0,0]=3 5767 B12R1.440 COc1cccc(c1O)C(=O)N 1P00BFPB [0,2,0,0,0,0|1,0,0]=3 5768 B12R1.440 COc1cccc(c1O)C(=O)O 1P003K4S [0,2,0,0,0,0|0,0,0]=2 5769 B12R1.440 COc1cccc(c1O)[N+](=O)[O-] 1P001RSB [0,2,0,0,0,0|1,0,1]=4 5770 B12R1.440 COc1cccc(c1S)C(=O)O 1P01BTNU [0,2,0,0,0,0|0,1,0]=3 5771 B12R1.440 COc1ccnc(c1Br)C(=O)O 1P0281BL [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.440 COc1ccnc(c1C)C(=O)O 1P00AAE9 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.440 COc1ccnc(c1C)C(=O)O 1P027ZUD [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.440 COc1ccnc(c1F)C(=O)O 1P01C45X [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.440 COc1ccnc(c1F)C(=O)O 1P01FKKY [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.440 COc1ccnc(c1N)C(=O)O 1P00IETB [0,2,0,0,0,0|2,0,0]=4 5777 B12R1.440 COc1ccnc(c1N)C(=O)O 1P0285OZ [0,2,0,0,0,0|2,0,0]=4 5778 B12R1.440 COc1ccnc(c1O)C(=O)O 1P002L52 [0,2,0,0,0,0|1,0,0]=3 5779 B12R1.440 COc1cncc(c1C)C(=O)O 1P01BY1H [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.440 COc1nccc(c1C)C(=O)O 1P009YPZ [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.440 COc1nccc(c1Cl)C(=O)O 1P007PLP [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.440 COc1nccc(c1F)C(=O)O 1P01BOCZ [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.440 COc1nccc(c1N)C(=O)O 1P0036VS [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.440 COc1nccc(c1O)C(=O)O 1P01XD9M [0,2,0,0,0,0|1,0,0]=3 5785 B12R1.440 CSc1cccc(c1Cl)C(=O)O 1P01DZG9 [0,2,0,0,0,0|1,0,0]=3 5786 B12R1.440 CSc1cccc(c1N)C(=O)N 1P028GQD [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.440 CSc1cccc(c1O)C(=O)O 1P019F9C [0,2,0,0,0,0|0,0,0]=2 5788 B12R1.440 ClCc1cccc(c1Cl)C(=O)O 1P028XYL [0,2,0,0,0,0|1,0,0]=3 5789 B12R1.440 N#Cc1cccc(c1Br)C(=O)O 1P000S8M [0,2,0,0,0,0|1,0,0]=3 5790 B12R1.440 N#Cc1cccc(c1C)C(=O)O 1P00CKY4 [0,2,0,0,0,0|1,0,0]=3 5791 B12R1.440 N#Cc1cccc(c1Cl)C(=O)O 1P000SA9 [0,2,0,0,0,0|1,0,0]=3 5792 B12R1.440 N#Cc1cccc(c1F)C(=O)O 1P00BI71 [0,2,0,0,0,0|1,0,0]=3 5793 B12R1.440 N#Cc1cccc(c1I)C(=O)O 1P00HBBE [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.440 N#Cc1cccc(c1O)C(=O)C 1P00A192 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.440 N#Cc1cccc(c1O)C(=O)N 1P027Y36 [0,2,0,0,0,0|1,0,0]=3 5796 B12R1.440 N#Cc1cccc(c1O)C(=O)O 1P00FH3V [0,2,0,0,0,0|0,0,0]=2 5797 B12R1.440 N#Cc1cccc(c1O)[N+](=O)[O-] 1P007LOH [0,2,0,0,0,0|1,0,1]=4 5798 B12R1.440 N#Cc1ccnc(c1Cl)C(=O)O 1P01XC19 [0,2,0,0,0,0|2,0,0]=4 5799 B12R1.440 N#Cc1ccnc(c1F)C(=O)O 1P01B681 [0,2,0,0,0,0|2,0,0]=4 5800 B12R1.440 NNc1cccc(c1C)C(=O)O 1P01C5Z7 [0,2,0,0,0,0|1,0,0]=3 5801 B12R1.440 NNc1cccc(c1F)C(=O)O 1P01C1S9 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.440 O=Cc1cccc(c1Br)C(=O)O 1P01FHPD [0,2,0,0,0,0|1,0,0]=3 5803 B12R1.440 O=Cc1cccc(c1C)C(=O)O 1P01BZOG [0,2,0,0,0,0|1,0,0]=3 5804 B12R1.440 O=Cc1cccc(c1Cl)C(=O)O 1P01B28O [0,2,0,0,0,0|1,0,0]=3 5805 B12R1.440 O=Cc1cccc(c1F)C(=O)N 1P028OZF [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.440 O=Cc1cccc(c1F)C(=O)O 1P00HSBR [0,2,0,0,0,0|1,0,0]=3 5807 B12R1.440 O=Cc1cccc(c1N)C(=O)O 1P007KAA [0,2,0,0,0,0|1,0,0]=3 5808 B12R1.440 O=Cc1cccc(c1O)C(=O)O 1P00EIZN [0,2,0,0,0,0|0,0,0]=2 5809 B12R1.440 O=Cc1cccc(c1O)C(=O)[O-] 1P01AUYR [0,2,0,0,0,0|0,0,1]=3 5810 B12R1.440 O=Cc1cccc(c1O)[N+](=O)[O-] 1P00I9W7 [0,2,0,0,0,0|1,0,1]=4 5811 B12R1.440 OCc1cccc(c1F)C(=O)O 1P00D8NM [0,2,0,0,0,0|1,0,0]=3 5812 B12R1.440 OCc1cccc(c1O)[N+](=O)[O-] 1P007LOI [0,2,0,0,0,0|1,0,1]=4 5813 B12R1.440 [N-]=[N+]=C1C=CC=C(C1=O)C(=O)O 1P01PUJU [0,2,0,0,0,0|0,0,1]=3 5814 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)C)N 1P009WKU [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)C)O 1P003J1J [0,2,0,0,0,0|1,0,0]=3 5816 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)O)C 1P0003RD [0,2,0,0,0,0|1,0,0]=3 5817 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)O)Cl 1P00BM9S [0,2,0,0,0,0|1,0,0]=3 5818 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)O)N 1P003GTP [0,2,0,0,0,0|1,0,0]=3 5819 B12R1.511 Brc1cc(Br)c(c(c1)C(=O)O)O 1P003J1W [0,2,0,0,0,0|0,0,0]=2 5820 B12R1.511 Brc1cc(Br)c(c(c1)[N+](=O)[O-])O 1P001RSA [0,2,0,0,0,0|1,0,1]=4 5821 B12R1.511 Brc1cc(C)c(c(c1)C(=O)C)O 1P00FGLW [0,2,0,0,0,0|1,0,0]=3 5822 B12R1.511 Brc1cc(C)c(c(c1)C(=O)O)C 1P01BG9H [0,2,0,0,0,0|1,0,0]=3 5823 B12R1.511 Brc1cc(C)c(c(c1)C(=O)O)F 1P00HX1S [0,2,0,0,0,0|1,0,0]=3 5824 B12R1.511 Brc1cc(C)c(c(c1)C(=O)O)I 1P000T4E [0,2,0,0,0,0|1,0,0]=3 5825 B12R1.511 Brc1cc(C)c(c(c1)C(=O)O)N 1P002IZ6 [0,2,0,0,0,0|1,0,0]=3 5826 B12R1.511 Brc1cc(C)c(c(c1)C(=O)O)O 1P00C0YX [0,2,0,0,0,0|0,0,0]=2 5827 B12R1.511 Brc1cc(C)c(c(c1)[N+](=O)[O-])O 1P00291W [0,2,0,0,0,0|1,0,1]=4 5828 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)C)O 1P01A020 [0,2,0,0,0,0|1,0,0]=3 5829 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)C 1P01C4SD [0,2,0,0,0,0|1,0,0]=3 5830 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)Cl 1P028LRP [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)F 1P00HXPG [0,2,0,0,0,0|1,0,0]=3 5832 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)N 1P00EMCX [0,2,0,0,0,0|1,0,0]=3 5833 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)N 1P01FIW5 [0,2,0,0,0,0|1,0,0]=3 5834 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)N 1P028C3G [0,2,0,0,0,0|1,0,0]=3 5835 B12R1.511 Brc1cc(Cl)c(c(c1)C(=O)O)O 1P00JHBG [0,2,0,0,0,0|0,0,0]=2 5836 B12R1.511 Brc1cc(Cl)c(c(c1)[N+](=O)[O-])O 1P00EL5Y [0,2,0,0,0,0|1,0,1]=4 5837 B12R1.511 Brc1cc(F)c(c(c1)C(=O)C)F 1P00HZ1I [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.511 Brc1cc(F)c(c(c1)C(=O)C)O 1P0091WP [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.511 Brc1cc(F)c(c(c1)C(=O)O)C 1P01KLL3 [0,2,0,0,0,0|1,0,0]=3 5840 B12R1.511 Brc1cc(F)c(c(c1)C(=O)O)F 1P004E7D [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.511 Brc1cc(F)c(c(c1)C(=O)O)N 1P00GVTC [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.511 Brc1cc(F)c(c(c1)C(=O)O)O 1P002R0Y [0,2,0,0,0,0|0,0,0]=2 5843 B12R1.511 Brc1cc(F)c(c(c1)[N+](=O)[O-])O 1P003LDB [0,2,0,0,0,0|1,0,1]=4 5844 B12R1.511 Brc1cc(I)c(c(c1)C(=O)O)C 1P01BWBL [0,2,0,0,0,0|1,0,0]=3 5845 B12R1.511 Brc1cc(I)c(c(c1)C(=O)O)F 1P021PLH [0,2,0,0,0,0|1,0,0]=3 5846 B12R1.511 Brc1cc(I)c(c(c1)[N+](=O)[O-])O 1P00IAUA [0,2,0,0,0,0|1,0,1]=4 5847 B12R1.511 Brc1cc(N)c(c(c1)C(=O)C)O 1P00FGLR [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.511 Brc1cc(N)c(c(c1)C(=O)O)C 1P00HVFN [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.511 Brc1cc(N)c(c(c1)C(=O)O)N 1P00ELFP [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.511 Brc1cc(N)c(c(c1)[N+](=O)[O-])O 1P001ATT [0,2,0,0,0,0|1,0,1]=4 5851 B12R1.511 Brc1cc(O)c(c(c1)C(=O)O)C 1P001JNV [0,2,0,0,0,0|1,0,0]=3 5852 B12R1.511 Brc1cc(O)c(c(c1)C(=O)O)O 1P0065EW [0,2,0,0,0,0|0,0,0]=2 5853 B12R1.511 Brc1cc(O)c(c(c1)[N+](=O)[O-])O 1P00FLU4 [0,2,0,0,0,0|1,0,1]=4 5854 B12R1.511 Brc1cn(C)c(=O)c(c1)C(=O)O 1P00GAKG [0,2,0,0,0,0|1,0,1]=4 5855 B12R1.511 Brc1cn(O)c(=O)c(c1)C(=O)O 1P028PYR [0,2,0,0,0,0|1,0,1]=4 5856 B12R1.511 Brc1nc(C)c(c(c1)C(=O)O)F 1P027U72 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)C)O 1P00EJYM [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)Cl)F 1P01BWAU [0,2,0,0,0,0|2,0,0]=4 5859 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)N)F 1P01BW0L [0,2,0,0,0,0|2,0,0]=4 5860 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)O)Br 1P01SWUQ [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)O)F 1P00ICQK [0,2,0,0,0,0|1,0,0]=3 5862 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)O)N 1P000VKD [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.511 Cc1cc(Br)c(c(c1)C(=O)O)O 1P0025SL [0,2,0,0,0,0|0,0,0]=2 5864 B12R1.511 Cc1cc(Br)c(c(c1)[N+](=O)[O-])O 1P002D6R [0,2,0,0,0,0|1,0,1]=4 5865 B12R1.511 Cc1cc(C)c(c(c1)C(=O)C)O 1P000Q5E [0,2,0,0,0,0|1,0,0]=3 5866 B12R1.511 Cc1cc(C)c(c(c1)C(=O)O)Br 1P01ACA3 [0,2,0,0,0,0|1,0,0]=3 5867 B12R1.511 Cc1cc(C)c(c(c1)C(=O)O)C 1P007O3C [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.511 Cc1cc(C)c(c(c1)C(=O)O)Cl 1P01EZGD [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.511 Cc1cc(C)c(c(c1)C(=O)O)N 1P001JVZ [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.511 Cc1cc(C)c(c(c1)C(=O)O)O 1P00EYWO [0,2,0,0,0,0|0,0,0]=2 5871 B12R1.511 Cc1cc(C)c(c(c1)[N+](=O)[O-])O 1P001K5J [0,2,0,0,0,0|1,0,1]=4 5872 B12R1.511 Cc1cc(Cl)c(c(c1)C(=O)C)O 1P01C8JD [0,2,0,0,0,0|1,0,0]=3 5873 B12R1.511 Cc1cc(Cl)c(c(c1)C(=O)O)Br 1P0282ET [0,2,0,0,0,0|1,0,0]=3 5874 B12R1.511 Cc1cc(Cl)c(c(c1)C(=O)O)N 1P00FJ82 [0,2,0,0,0,0|1,0,0]=3 5875 B12R1.511 Cc1cc(Cl)c(c(c1)[N+](=O)[O-])O 1P01HQN5 [0,2,0,0,0,0|1,0,1]=4 5876 B12R1.511 Cc1cc(F)c(c(c1)C(=O)O)F 1P00028I [0,2,0,0,0,0|1,0,0]=3 5877 B12R1.511 Cc1cc(F)c(c(c1)C(=O)O)N 1P01XBMC [0,2,0,0,0,0|1,0,0]=3 5878 B12R1.511 Cc1cc(I)c(c(c1)C(=O)O)N 1P01ED6V [0,2,0,0,0,0|1,0,0]=3 5879 B12R1.511 Cc1cc(I)c(c(c1)C(=O)O)O 1P01ELT5 [0,2,0,0,0,0|0,0,0]=2 5880 B12R1.511 Cc1cc(N)c(c(c1)C(=O)C)O 1P00HDMR [0,2,0,0,0,0|1,0,0]=3 5881 B12R1.511 Cc1cc(N)c(c(c1)C(=O)O)C 1P028T8W [0,2,0,0,0,0|1,0,0]=3 5882 B12R1.511 Cc1cc(O)c(c(c1)[N+](=O)[O-])O 1P01FYQ0 [0,2,0,0,0,0|1,0,1]=4 5883 B12R1.511 Cc1nc(C)c(c(c1)C(=O)O)O 1P028H4Z [0,2,0,0,0,0|1,0,0]=3 5884 B12R1.511 Cc1nc(Cl)c(c(c1)C(=O)O)N 1P01B8VA [0,2,0,0,0,0|2,0,0]=4 5885 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)C)O 1P003411 [0,2,0,0,0,0|1,0,0]=3 5886 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)O)C 1P01FDKA [0,2,0,0,0,0|1,0,0]=3 5887 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)O)Cl 1P01EY9T [0,2,0,0,0,0|1,0,0]=3 5888 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)O)F 1P000TY7 [0,2,0,0,0,0|1,0,0]=3 5889 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)O)N 1P00CA7Y [0,2,0,0,0,0|1,0,0]=3 5890 B12R1.511 Clc1cc(Br)c(c(c1)C(=O)O)O 1P00CRZC [0,2,0,0,0,0|0,0,0]=2 5891 B12R1.511 Clc1cc(Br)c(c(c1)[N+](=O)[O-])O 1P001RS9 [0,2,0,0,0,0|1,0,1]=4 5892 B12R1.511 Clc1cc(Br)c(c(n1)C(=O)O)N 1P00HBFQ [0,2,0,0,0,0|2,0,0]=4 5893 B12R1.511 Clc1cc(C)c(c(c1)C(=O)C)O 1P01B9D5 [0,2,0,0,0,0|1,0,0]=3 5894 B12R1.511 Clc1cc(C)c(c(c1)C(=O)N)N 1P01QCJ9 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.511 Clc1cc(C)c(c(c1)C(=O)O)C 1P028BM4 [0,2,0,0,0,0|1,0,0]=3 5896 B12R1.511 Clc1cc(C)c(c(c1)C(=O)O)N 1P002JQY [0,2,0,0,0,0|1,0,0]=3 5897 B12R1.511 Clc1cc(C)c(c(c1)C(=O)O)O 1P0073CU [0,2,0,0,0,0|0,0,0]=2 5898 B12R1.511 Clc1cc(C)c(c(c1)[N+](=O)[O-])O 1P0021TC [0,2,0,0,0,0|1,0,1]=4 5899 B12R1.511 Clc1cc(C)c(c(n1)C(=O)O)Br 1P0285IB [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.511 Clc1cc(C)c(c(n1)C(=O)O)N 1P00HBFP [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)C)F 1P00I97S [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)C)O 1P003J23 [0,2,0,0,0,0|1,0,0]=3 5903 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)Br 1P01OUM9 [0,2,0,0,0,0|1,0,0]=3 5904 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)Cl 1P003FVT [0,2,0,0,0,0|1,0,0]=3 5905 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)F 1P00FE5W [0,2,0,0,0,0|1,0,0]=3 5906 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)I 1P00AZA1 [0,2,0,0,0,0|1,0,0]=3 5907 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)N 1P003J2C [0,2,0,0,0,0|1,0,0]=3 5908 B12R1.511 Clc1cc(Cl)c(c(c1)C(=O)O)O 1P003J24 [0,2,0,0,0,0|0,0,0]=2 5909 B12R1.511 Clc1cc(Cl)c(c(c1)[N+](=O)[O-])O 1P003G7J [0,2,0,0,0,0|1,0,1]=4 5910 B12R1.511 Clc1cc(Cl)c(c(n1)C(=O)O)C 1P027Y43 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.511 Clc1cc(Cl)c(c(n1)C(=O)O)N 1P0099RM [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.511 Clc1cc(F)c(c(c1)C(=O)C)Cl 1P0251E2 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.511 Clc1cc(F)c(c(c1)C(=O)O)Br 1P01B9KT [0,2,0,0,0,0|1,0,0]=3 5914 B12R1.511 Clc1cc(F)c(c(c1)C(=O)O)Cl 1P00DAWJ [0,2,0,0,0,0|1,0,0]=3 5915 B12R1.511 Clc1cc(F)c(c(c1)C(=O)O)F 1P000JO3 [0,2,0,0,0,0|1,0,0]=3 5916 B12R1.511 Clc1cc(F)c(c(c1)C(=O)O)N 1P0092VQ [0,2,0,0,0,0|1,0,0]=3 5917 B12R1.511 Clc1cc(F)c(c(c1)C(=O)O)O 1P005645 [0,2,0,0,0,0|0,0,0]=2 5918 B12R1.511 Clc1cc(I)c(c(c1)C(=O)O)Br 1P01FGTH [0,2,0,0,0,0|1,0,0]=3 5919 B12R1.511 Clc1cc(I)c(c(c1)C(=O)O)N 1P00EH6P [0,2,0,0,0,0|1,0,0]=3 5920 B12R1.511 Clc1cc(N)c(c(c1)C(=O)O)Cl 1P0011YS [0,2,0,0,0,0|1,0,0]=3 5921 B12R1.511 Clc1cc(N)c(c(c1)C(=O)O)F 1P019TJV [0,2,0,0,0,0|1,0,0]=3 5922 B12R1.511 Clc1cc(N)c(c(c1)C(=O)O)O 1P00FJFX [0,2,0,0,0,0|0,0,0]=2 5923 B12R1.511 Clc1cc(N)c(c(c1)[N+](=O)[O-])O 1P003GVN [0,2,0,0,0,0|1,0,1]=4 5924 B12R1.511 Clc1cc(N)c(c(n1)C(=O)O)Br 1P01C4K4 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.511 Clc1cc(N)c(c(n1)C(=O)O)Cl 1P001MT8 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.511 Clc1cc(O)c(c(n1)C(=O)O)Cl 1P00G8UT [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.511 Clc1nc(Br)c(c(c1)C(=O)O)N 1P021VSH [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.511 Clc1nc(Cl)c(c(c1)C(=O)O)C 1P009YPY [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.511 Clc1nc(Cl)c(c(c1)C(=O)O)F 1P001M6T [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.511 Clc1nc(Cl)c(c(c1)C(=O)O)N 1P00EK6X [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.511 Clc1nc(Cl)c(c(c1)C(=O)O)O 1P00AOOK [0,2,0,0,0,0|1,0,0]=3 5932 B12R1.511 Cn1cc(Br)c(=O)c(c1)C(=O)O 1P01FJ14 [0,2,0,0,0,0|1,0,1]=4 5933 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)C)O 1P01KBH4 [0,2,0,0,0,0|1,0,0]=3 5934 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)O)C 1P00924I [0,2,0,0,0,0|1,0,0]=3 5935 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)O)Cl 1P01FDPA [0,2,0,0,0,0|1,0,0]=3 5936 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)O)F 1P00HYEC [0,2,0,0,0,0|1,0,0]=3 5937 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)O)N 1P002RJN [0,2,0,0,0,0|1,0,0]=3 5938 B12R1.511 Fc1cc(Br)c(c(c1)C(=O)O)O 1P01B1QS [0,2,0,0,0,0|0,0,0]=2 5939 B12R1.511 Fc1cc(Br)c(c(c1)[N+](=O)[O-])O 1P00C1F0 [0,2,0,0,0,0|1,0,1]=4 5940 B12R1.511 Fc1cc(C)c(c(c1)C(=O)O)Br 1P0010D7 [0,2,0,0,0,0|1,0,0]=3 5941 B12R1.511 Fc1cc(C)c(c(c1)C(=O)O)C 1P028AF4 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.511 Fc1cc(C)c(c(c1)C(=O)O)I 1P01ELUF [0,2,0,0,0,0|1,0,0]=3 5943 B12R1.511 Fc1cc(C)c(c(c1)C(=O)O)N 1P01A883 [0,2,0,0,0,0|1,0,0]=3 5944 B12R1.511 Fc1cc(C)c(c(c1)C(=O)O)O 1P027UQ5 [0,2,0,0,0,0|0,0,0]=2 5945 B12R1.511 Fc1cc(C)c(c(c1)[N+](=O)[O-])O 1P001RF0 [0,2,0,0,0,0|1,0,1]=4 5946 B12R1.511 Fc1cc(Cl)c(c(c1)C(=O)O)Br 1P024VLF [0,2,0,0,0,0|1,0,0]=3 5947 B12R1.511 Fc1cc(Cl)c(c(c1)C(=O)O)C 1P01KL8V [0,2,0,0,0,0|1,0,0]=3 5948 B12R1.511 Fc1cc(Cl)c(c(c1)C(=O)O)Cl 1P01FERS [0,2,0,0,0,0|1,0,0]=3 5949 B12R1.511 Fc1cc(Cl)c(c(c1)C(=O)O)N 1P0007LD [0,2,0,0,0,0|1,0,0]=3 5950 B12R1.511 Fc1cc(Cl)c(c(c1)C(=O)O)O 1P00C7O6 [0,2,0,0,0,0|0,0,0]=2 5951 B12R1.511 Fc1cc(F)c(c(c1)B(O)O)O 1P000G3E [0,2,0,0,0,0|1,0,1]=4 5952 B12R1.511 Fc1cc(F)c(c(c1)C(=O)C)F 1P003FVY [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.511 Fc1cc(F)c(c(c1)C(=O)C)O 1P001D55 [0,2,0,0,0,0|1,0,0]=3 5954 B12R1.511 Fc1cc(F)c(c(c1)C(=O)N)C 1P009J2H [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.511 Fc1cc(F)c(c(c1)C(=O)N)F 1P006UXQ [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)Br 1P003A3C [0,2,0,0,0,0|1,0,0]=3 5957 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)C 1P00028G [0,2,0,0,0,0|1,0,0]=3 5958 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)Cl 1P00ATM3 [0,2,0,0,0,0|1,0,0]=3 5959 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)F 1P003BKB [0,2,0,0,0,0|1,0,0]=3 5960 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)N 1P000TJT [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.511 Fc1cc(F)c(c(c1)C(=O)O)O 1P004XN2 [0,2,0,0,0,0|0,0,0]=2 5962 B12R1.511 Fc1cc(F)c(c(c1)[N+](=O)[O-])O 1P003AFG [0,2,0,0,0,0|1,0,1]=4 5963 B12R1.511 Fc1cc(I)c(c(c1)C(=O)N)O 1P01XA8H [0,2,0,0,0,0|1,0,0]=3 5964 B12R1.511 Fc1cc(I)c(c(c1)C(=O)O)C 1P02935G [0,2,0,0,0,0|1,0,0]=3 5965 B12R1.511 Fc1cc(I)c(c(c1)C(=O)O)N 1P00CNSF [0,2,0,0,0,0|1,0,0]=3 5966 B12R1.511 Fc1cc(N)c(c(c1)C(=O)C)C 1P01KLOR [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.511 Fc1cc(N)c(c(c1)C(=O)O)C 1P002PHL [0,2,0,0,0,0|1,0,0]=3 5968 B12R1.511 Fc1cc(N)c(c(c1)C(=O)O)C 1P01A4JA [0,2,0,0,0,0|1,0,0]=3 5969 B12R1.511 Fc1cc(N)c(c(c1)C(=O)O)F 1P01AKBU [0,2,0,0,0,0|1,0,0]=3 5970 B12R1.511 Fc1cc(N)c(c(c1)C(=O)O)N 1P002642 [0,2,0,0,0,0|1,0,0]=3 5971 B12R1.511 Fc1nc(F)c(c(c1)C(=O)O)F 1P003FWI [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.511 Ic1cc(Br)c(c(c1)C(=O)O)C 1P0007M1 [0,2,0,0,0,0|1,0,0]=3 5973 B12R1.511 Ic1cc(Br)c(c(c1)[N+](=O)[O-])O 1P01FHOH [0,2,0,0,0,0|1,0,1]=4 5974 B12R1.511 Ic1cc(C)c(c(c1)C(=O)O)C 1P01A0ZO [0,2,0,0,0,0|1,0,0]=3 5975 B12R1.511 Ic1cc(C)c(c(c1)C(=O)O)N 1P007C5G [0,2,0,0,0,0|1,0,0]=3 5976 B12R1.511 Ic1cc(Cl)c(c(c1)C(=O)O)C 1P01DZB6 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.511 Ic1cc(Cl)c(c(c1)C(=O)O)F 1P00H9KV [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.511 Ic1cc(F)c(c(c1)C(=O)O)F 1P00CM91 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.511 Ic1cc(F)c(c(c1)C(=O)O)N 1P021WKS [0,2,0,0,0,0|1,0,0]=3 5980 B12R1.511 Ic1cc(I)c(c(c1)C(=O)O)I 1P0033DX [0,2,0,0,0,0|1,0,0]=3 5981 B12R1.511 Ic1cc(I)c(c(c1)C(=O)O)N 1P003GTU [0,2,0,0,0,0|1,0,0]=3 5982 B12R1.511 Ic1cc(I)c(c(c1)C(=O)O)O 1P0011YR [0,2,0,0,0,0|0,0,0]=2 5983 B12R1.511 Ic1cc(I)c(c(c1)C(=O)O)O 1P008YHV [0,2,0,0,0,0|0,0,0]=2 5984 B12R1.511 Ic1cc(I)c(c(c1)C(=O)[O-])O 1P003J49 [0,2,0,0,0,0|0,0,1]=3 5985 B12R1.511 Nc1cc(Br)c(c(c1)C(=O)O)C 1P01B9V9 [0,2,0,0,0,0|1,0,0]=3 5986 B12R1.511 Nc1cc(Br)c(c(c1)C(=O)O)O 1P028L75 [0,2,0,0,0,0|0,0,0]=2 5987 B12R1.511 Nc1cc(C)c(c(c1)C(=O)O)C 1P0291DA [0,2,0,0,0,0|1,0,0]=3 5988 B12R1.511 Nc1cc(C)c(c(c1)C(=O)O)F 1P028ANH [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.511 Nc1cc(C)c(c(c1)C(=O)O)O 1P00EBB7 [0,2,0,0,0,0|0,0,0]=2 5990 B12R1.511 Nc1cc(Cl)c(c(c1)C(=O)O)Cl 1P00DL98 [0,2,0,0,0,0|1,0,0]=3 5991 B12R1.511 Nc1cc(F)c(c(c1)C(=O)O)F 1P00IF3M [0,2,0,0,0,0|1,0,0]=3 5992 B12R1.511 Nc1cc(N)c(c(c1)C(=O)O)O 1P007SUH [0,2,0,0,0,0|0,0,0]=2 5993 B12R1.511 Nc1cc(N)c(c(c1)C(=O)O)O 1P01FSNO [0,2,0,0,0,0|0,0,0]=2 5994 B12R1.511 Nc1cc(O)c(c(c1)C(=O)O)Br 1P01DT8R [0,2,0,0,0,0|1,0,0]=3 5995 B12R1.511 Nc1cc(O)c(c(c1)C(=O)O)C 1P01FIVY [0,2,0,0,0,0|1,0,0]=3 5996 B12R1.511 Nc1cc(O)c(c(c1)C(=O)O)F 1P000836 [0,2,0,0,0,0|1,0,0]=3 5997 B12R1.511 Nc1cc(O)c(c(c1)C(=O)O)F 1P0286FP [0,2,0,0,0,0|1,0,0]=3 5998 B12R1.511 Nc1cc(O)c(c(c1)C(=O)O)O 1P005OMP [0,2,0,0,0,0|0,0,0]=2 5999 B12R1.511 O=c1cc(C)n(c(c1)C(=O)O)C 1P00HV4J [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.511 Oc1cc(Br)c(c(c1)C(=O)O)Br 1P0293EM [0,2,0,0,0,0|1,0,0]=3 6001 B12R1.511 Oc1cc(Cl)c(c(c1)C(=O)O)Cl 1P028OPI [0,2,0,0,0,0|1,0,0]=3 6002 B12R1.511 Oc1cc(F)c(c(c1)C(=O)O)F 1P00373Z [0,2,0,0,0,0|1,0,0]=3 6003 B12R1.511 Oc1cc(N)c(c(c1)C(=O)O)Br 1P01FIT5 [0,2,0,0,0,0|1,0,0]=3 6004 B12R1.511 Oc1cc(N)c(c(c1)C(=O)O)C 1P028Q7O [0,2,0,0,0,0|1,0,0]=3 6005 B12R1.511 Oc1cc(N)c(c(c1)C(=O)O)Cl 1P01ELYK [0,2,0,0,0,0|1,0,0]=3 6006 B12R1.511 Oc1cc(N)c(c(c1)C(=O)O)F 1P01FIU1 [0,2,0,0,0,0|1,0,0]=3 6007 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1P01KA4W [0,2,0,0,0,0|2,0,0]=4 6008 B12R1.893 CC(=O)c1ccc(c(c1C)C)F 1P0283Y7 [0,2,0,0,0,0|2,0,0]=4 6009 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1P00AEMA [0,2,0,0,0,0|2,0,0]=4 6010 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1P00M5XN [0,2,0,0,0,0|2,0,0]=4 6011 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Cl 1P003FUR [0,2,0,0,0,0|2,0,0]=4 6012 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1P0251JN [0,2,0,0,0,0|2,0,0]=4 6013 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1P008ZPH [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1P01K96Z [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1P01KKJ5 [0,2,0,0,0,0|2,0,0]=4 6016 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1P022KRQ [0,2,0,0,0,0|2,0,0]=4 6017 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1P003FUT [0,2,0,0,0,0|2,0,0]=4 6018 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1P01AVIC [0,2,0,0,0,0|2,0,0]=4 6019 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1P01DXD9 [0,2,0,0,0,0|2,0,0]=4 6020 B12R1.893 CC(=O)c1ccc(c(c1N)C)O 1P008TQZ [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.893 CC(=O)c1ccc(c(c1N)F)F 1P028MB6 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1P01AAVZ [0,2,0,0,0,0|1,0,0]=3 6023 B12R1.893 CC(=O)c1ccc(c(c1O)C)O 1P0004U7 [0,2,0,0,0,0|1,0,0]=3 6024 B12R1.893 CC(=O)c1ccc(c(c1O)Cl)Cl 1P01AA6W [0,2,0,0,0,0|1,0,0]=3 6025 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1P00GPHE [0,2,0,0,0,0|1,0,0]=3 6026 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1P003FUX [0,2,0,0,0,0|1,0,0]=3 6027 B12R1.893 ClC(=O)c1ccc(c(c1C)Br)C 1P01BDEQ [0,2,0,0,0,0|2,0,0]=4 6028 B12R1.893 ClC(=O)c1ccc(c(c1F)F)F 1P001PVK [0,2,0,0,0,0|2,0,0]=4 6029 B12R1.893 NC(=O)c1ccc(c(c1F)F)C 1P002SJ3 [0,2,0,0,0,0|2,0,0]=4 6030 B12R1.893 NC(=O)c1ccc(c(c1F)F)F 1P002JU7 [0,2,0,0,0,0|2,0,0]=4 6031 B12R1.893 OC(=O)c1ccc(c(c1Br)Cl)F 1P025GAQ [0,2,0,0,0,0|1,0,0]=3 6032 B12R1.893 OC(=O)c1ccc(c(c1Br)F)C 1P028ROC [0,2,0,0,0,0|1,0,0]=3 6033 B12R1.893 OC(=O)c1ccc(c(c1Br)F)Cl 1P01DI86 [0,2,0,0,0,0|1,0,0]=3 6034 B12R1.893 OC(=O)c1ccc(c(c1Br)F)F 1P00ACK3 [0,2,0,0,0,0|1,0,0]=3 6035 B12R1.893 OC(=O)c1ccc(c(c1Br)F)N 1P023ZY8 [0,2,0,0,0,0|1,0,0]=3 6036 B12R1.893 OC(=O)c1ccc(c(c1Br)O)Br 1P0201ZX [0,2,0,0,0,0|1,0,0]=3 6037 B12R1.893 OC(=O)c1ccc(c(c1C)Br)C 1P01B23E [0,2,0,0,0,0|1,0,0]=3 6038 B12R1.893 OC(=O)c1ccc(c(c1C)C)F 1P00HC6L [0,2,0,0,0,0|1,0,0]=3 6039 B12R1.893 OC(=O)c1ccc(c(c1C)C)N 1P003L4S [0,2,0,0,0,0|1,0,0]=3 6040 B12R1.893 OC(=O)c1ccc(c(c1C)C)O 1P00ELJ5 [0,2,0,0,0,0|1,0,0]=3 6041 B12R1.893 OC(=O)c1ccc(c(c1C)Cl)Br 1P00KING [0,2,0,0,0,0|1,0,0]=3 6042 B12R1.893 OC(=O)c1ccc(c(c1C)Cl)Cl 1P01SEC7 [0,2,0,0,0,0|1,0,0]=3 6043 B12R1.893 OC(=O)c1ccc(c(c1C)F)Br 1P009Y6T [0,2,0,0,0,0|1,0,0]=3 6044 B12R1.893 OC(=O)c1ccc(c(c1C)F)F 1P001Q2L [0,2,0,0,0,0|1,0,0]=3 6045 B12R1.893 OC(=O)c1ccc(c(c1C)N)O 1P01DT0U [0,2,0,0,0,0|1,0,0]=3 6046 B12R1.893 OC(=O)c1ccc(c(c1Cl)Br)Cl 1P00IJ9S [0,2,0,0,0,0|1,0,0]=3 6047 B12R1.893 OC(=O)c1ccc(c(c1Cl)C)C 1P01A6SX [0,2,0,0,0,0|1,0,0]=3 6048 B12R1.893 OC(=O)c1ccc(c(c1Cl)C)Cl 1P004TJH [0,2,0,0,0,0|1,0,0]=3 6049 B12R1.893 OC(=O)c1ccc(c(c1Cl)C)F 1P001Z93 [0,2,0,0,0,0|1,0,0]=3 6050 B12R1.893 OC(=O)c1ccc(c(c1Cl)C)I 1P028Z24 [0,2,0,0,0,0|1,0,0]=3 6051 B12R1.893 OC(=O)c1ccc(c(c1Cl)Cl)Br 1P01DDKP [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.893 OC(=O)c1ccc(c(c1Cl)Cl)C 1P01A3HI [0,2,0,0,0,0|1,0,0]=3 6053 B12R1.893 OC(=O)c1ccc(c(c1Cl)Cl)F 1P00ACJY [0,2,0,0,0,0|1,0,0]=3 6054 B12R1.893 OC(=O)c1ccc(c(c1Cl)Cl)N 1P0034CO [0,2,0,0,0,0|1,0,0]=3 6055 B12R1.893 OC(=O)c1ccc(c(c1Cl)F)F 1P001N2J [0,2,0,0,0,0|1,0,0]=3 6056 B12R1.893 OC(=O)c1ccc(c(c1Cl)F)N 1P0034CQ [0,2,0,0,0,0|1,0,0]=3 6057 B12R1.893 OC(=O)c1ccc(c(c1Cl)F)O 1P024FJJ [0,2,0,0,0,0|1,0,0]=3 6058 B12R1.893 OC(=O)c1ccc(c(c1Cl)F)S 1P01DZIH [0,2,0,0,0,0|1,0,0]=3 6059 B12R1.893 OC(=O)c1ccc(c(c1Cl)N)Cl 1P00DHQU [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.893 OC(=O)c1ccc(c(c1Cl)O)Br 1P01M8L8 [0,2,0,0,0,0|1,0,0]=3 6061 B12R1.893 OC(=O)c1ccc(c(c1Cl)O)O 1P003A4V [0,2,0,0,0,0|1,0,0]=3 6062 B12R1.893 OC(=O)c1ccc(c(c1F)Br)C 1P01BRIF [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.893 OC(=O)c1ccc(c(c1F)Br)Cl 1P01DNLF [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.893 OC(=O)c1ccc(c(c1F)Br)F 1P00390Y [0,2,0,0,0,0|1,0,0]=3 6065 B12R1.893 OC(=O)c1ccc(c(c1F)Br)O 1P027X3M [0,2,0,0,0,0|1,0,0]=3 6066 B12R1.893 OC(=O)c1ccc(c(c1F)C)Br 1P003A70 [0,2,0,0,0,0|1,0,0]=3 6067 B12R1.893 OC(=O)c1ccc(c(c1F)C)C 1P0201NE [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.893 OC(=O)c1ccc(c(c1F)C)Cl 1P003LJO [0,2,0,0,0,0|1,0,0]=3 6069 B12R1.893 OC(=O)c1ccc(c(c1F)C)F 1P00826H [0,2,0,0,0,0|1,0,0]=3 6070 B12R1.893 OC(=O)c1ccc(c(c1F)C)N 1P00AVBS [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.893 OC(=O)c1ccc(c(c1F)Cl)Br 1P00AKRN [0,2,0,0,0,0|1,0,0]=3 6072 B12R1.893 OC(=O)c1ccc(c(c1F)Cl)C 1P01BGFL [0,2,0,0,0,0|1,0,0]=3 6073 B12R1.893 OC(=O)c1ccc(c(c1F)Cl)F 1P00HYOK [0,2,0,0,0,0|1,0,0]=3 6074 B12R1.893 OC(=O)c1ccc(c(c1F)F)Br 1P007RWB [0,2,0,0,0,0|1,0,0]=3 6075 B12R1.893 OC(=O)c1ccc(c(c1F)F)C 1P002SJ1 [0,2,0,0,0,0|1,0,0]=3 6076 B12R1.893 OC(=O)c1ccc(c(c1F)F)Cl 1P001N3Q [0,2,0,0,0,0|1,0,0]=3 6077 B12R1.893 OC(=O)c1ccc(c(c1F)F)F 1P0033DU [0,2,0,0,0,0|1,0,0]=3 6078 B12R1.893 OC(=O)c1ccc(c(c1F)F)I 1P00D8VL [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.893 OC(=O)c1ccc(c(c1F)F)N 1P007RWC [0,2,0,0,0,0|1,0,0]=3 6080 B12R1.893 OC(=O)c1ccc(c(c1F)F)O 1P0021RZ [0,2,0,0,0,0|1,0,0]=3 6081 B12R1.893 OC(=O)c1ccc(c(c1F)I)C 1P00IFHR [0,2,0,0,0,0|1,0,0]=3 6082 B12R1.893 OC(=O)c1ccc(c(c1F)N)F 1P01C7S4 [0,2,0,0,0,0|1,0,0]=3 6083 B12R1.893 OC(=O)c1ccc(c(c1F)N)F 1P02851Z [0,2,0,0,0,0|1,0,0]=3 6084 B12R1.893 OC(=O)c1ccc(c(c1F)O)F 1P00GV2G [0,2,0,0,0,0|1,0,0]=3 6085 B12R1.893 OC(=O)c1ccc(c(c1I)C)C 1P000U76 [0,2,0,0,0,0|1,0,0]=3 6086 B12R1.893 OC(=O)c1ccc(c(c1N)Br)C 1P00CL3O [0,2,0,0,0,0|1,0,0]=3 6087 B12R1.893 OC(=O)c1ccc(c(c1N)Br)Cl 1P021WPT [0,2,0,0,0,0|1,0,0]=3 6088 B12R1.893 OC(=O)c1ccc(c(c1N)Br)F 1P01V24U [0,2,0,0,0,0|1,0,0]=3 6089 B12R1.893 OC(=O)c1ccc(c(c1N)C)Br 1P000U77 [0,2,0,0,0,0|1,0,0]=3 6090 B12R1.893 OC(=O)c1ccc(c(c1N)C)C 1P003GTL [0,2,0,0,0,0|1,0,0]=3 6091 B12R1.893 OC(=O)c1ccc(c(c1N)C)Cl 1P019XGC [0,2,0,0,0,0|1,0,0]=3 6092 B12R1.893 OC(=O)c1ccc(c(c1N)C)F 1P000U78 [0,2,0,0,0,0|1,0,0]=3 6093 B12R1.893 OC(=O)c1ccc(c(c1N)Cl)Br 1P023O6T [0,2,0,0,0,0|1,0,0]=3 6094 B12R1.893 OC(=O)c1ccc(c(c1N)Cl)C 1P01BRX7 [0,2,0,0,0,0|1,0,0]=3 6095 B12R1.893 OC(=O)c1ccc(c(c1N)Cl)Cl 1P002JR0 [0,2,0,0,0,0|1,0,0]=3 6096 B12R1.893 OC(=O)c1ccc(c(c1N)Cl)F 1P023RTB [0,2,0,0,0,0|1,0,0]=3 6097 B12R1.893 OC(=O)c1ccc(c(c1N)F)Br 1P001H4M [0,2,0,0,0,0|1,0,0]=3 6098 B12R1.893 OC(=O)c1ccc(c(c1N)F)Cl 1P003AP8 [0,2,0,0,0,0|1,0,0]=3 6099 B12R1.893 OC(=O)c1ccc(c(c1N)F)F 1P001QRJ [0,2,0,0,0,0|1,0,0]=3 6100 B12R1.893 OC(=O)c1ccc(c(c1N)N)F 1P0293EU [0,2,0,0,0,0|1,0,0]=3 6101 B12R1.893 OC(=O)c1ccc(c(c1N)O)Cl 1P002N0P [0,2,0,0,0,0|1,0,0]=3 6102 B12R1.893 OC(=O)c1ccc(c(c1N)O)Cl 1P01FIVZ [0,2,0,0,0,0|1,0,0]=3 6103 B12R1.893 OC(=O)c1ccc(c(c1O)Br)C 1P0282EK [0,2,0,0,0,0|0,0,0]=2 6104 B12R1.893 OC(=O)c1ccc(c(c1O)C)C 1P00EJ0U [0,2,0,0,0,0|0,0,0]=2 6105 B12R1.893 OC(=O)c1ccc(c(c1O)C)Cl 1P028ZM8 [0,2,0,0,0,0|0,0,0]=2 6106 B12R1.893 OC(=O)c1ccc(c(c1O)C)F 1P027XH9 [0,2,0,0,0,0|0,0,0]=2 6107 B12R1.893 OC(=O)c1ccc(c(c1O)C)O 1P00DUQL [0,2,0,0,0,0|0,0,0]=2 6108 B12R1.893 OC(=O)c1ccc(c(c1O)Cl)Cl 1P01ABYL [0,2,0,0,0,0|0,0,0]=2 6109 B12R1.893 OC(=O)c1ccc(c(c1O)Cl)N 1P01BDWN [0,2,0,0,0,0|0,0,0]=2 6110 B12R1.893 OC(=O)c1ccc(c(c1O)F)Br 1P00HX7Q [0,2,0,0,0,0|0,0,0]=2 6111 B12R1.893 OC(=O)c1ccc(c(c1O)F)Cl 1P01DTSU [0,2,0,0,0,0|0,0,0]=2 6112 B12R1.893 OC(=O)c1ccc(c(c1O)F)F 1P002INR [0,2,0,0,0,0|0,0,0]=2 6113 B12R1.893 OC(=O)c1ccc(c(c1O)O)C 1P019NSX [0,2,0,0,0,0|0,0,0]=2 6114 B12R1.893 OC(=O)c1ccc(c(c1O)O)O 1P003FUY [0,2,0,0,0,0|0,0,0]=2 6115 B12R1.893 OC(=O)c1ccc(n(c1=O)C)C 1P00GW8H [0,2,0,0,0,0|1,0,1]=4 6116 B12R1.893 OC(=O)c1ccn(c(=O)c1O)C 1P01C7KA [0,2,0,0,0,0|1,0,0]=3 6117 B12R1.893 OC(=O)c1cnc(c(c1Br)Cl)C 1P01A3BV [0,2,0,0,0,0|2,0,0]=4 6118 B12R1.893 OC(=O)c1cnc(c(c1Br)Cl)C 1P028RFV [0,2,0,0,0,0|2,0,0]=4 6119 B12R1.893 OC(=O)c1cnc(c(c1C)Br)O 1P027W3R [0,2,0,0,0,0|2,0,0]=4 6120 B12R1.893 OC(=O)c1cnc(c(c1Cl)Br)C 1P01A0O4 [0,2,0,0,0,0|2,0,0]=4 6121 B12R1.893 OC(=O)c1cnc(c(c1Cl)Br)Cl 1P01F46N [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.893 OC(=O)c1cnc(c(c1Cl)C)Cl 1P01K1B5 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.893 OC(=O)c1cnc(c(c1Cl)Cl)C 1P01A1H6 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.893 OC(=O)c1cnc(c(c1Cl)F)Cl 1P007HB4 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.893 OC(=O)c1cnc(c(c1Cl)F)F 1P004R94 [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.893 OC(=O)c1cnc(c(c1N)F)Cl 1P024XJ3 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.893 OC(=O)c1cnc(c(c1O)Br)C 1P01A0MA [0,2,0,0,0,0|1,0,0]=3 6128 B12R1.893 OC(=O)c1cnc(c(c1O)Cl)C 1P01A0ZS [0,2,0,0,0,0|1,0,0]=3 6129 B12R1.893 OC(=O)c1ncc(c(c1Cl)Cl)Cl 1P00DBWZ [0,2,0,0,0,0|2,0,0]=4 6130 B12R1.893 OC(=O)c1ncc(c(c1Cl)N)Cl 1P020N3X [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.893 OC(=O)c1nnc(c(c1O)Br)O 1P028Q2A [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.893 [O-]C(=O)c1ccc(c(c1F)F)F 1P00C0Q8 [0,2,0,0,0,0|1,0,1]=4 6133 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)Br)F 1P008W3A [0,2,0,0,0,0|1,0,1]=4 6134 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)C)O 1P01ITHY [0,2,0,0,0,0|1,0,1]=4 6135 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)Cl)Br 1P0293FU [0,2,0,0,0,0|1,0,1]=4 6136 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)Cl)Cl 1P00BDKU [0,2,0,0,0,0|1,0,1]=4 6137 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)F)Cl 1P0036W1 [0,2,0,0,0,0|1,0,1]=4 6138 B12R1.893 [O-][N+](=O)c1ccc(c(c1O)F)F 1P004XFV [0,2,0,0,0,0|1,0,1]=4 6139 B12R1.232 Brc1cc(C(=O)O)c(cc1C)Br 1P002KB8 [0,2,0,0,0,0|1,0,0]=3 6140 B12R1.232 Brc1cc(C(=O)O)c(cc1O)Br 1P0004XK [0,2,0,0,0,0|1,0,0]=3 6141 B12R1.232 CC(=O)c1cc(Br)c(cc1F)F 1P004N6E [0,2,0,0,0,0|2,0,0]=4 6142 B12R1.232 CC(=O)c1cc(Br)c(cc1N)C 1P00G89O [0,2,0,0,0,0|2,0,0]=4 6143 B12R1.232 CC(=O)c1cc(Br)c(cc1N)Cl 1P006EMC [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.232 CC(=O)c1cc(Br)c(cc1N)F 1P01BKXI [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.232 CC(=O)c1cc(Br)c(cc1O)F 1P003AIL [0,2,0,0,0,0|1,0,0]=3 6146 B12R1.232 CC(=O)c1cc(C)c(cc1Cl)C 1P001NEJ [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.232 CC(=O)c1cc(C)c(cc1F)Cl 1P0025N2 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.232 CC(=O)c1cc(C)c(cc1O)Br 1P003LDO [0,2,0,0,0,0|1,0,0]=3 6149 B12R1.232 CC(=O)c1cc(C)c(cc1O)C 1P003HUY [0,2,0,0,0,0|1,0,0]=3 6150 B12R1.232 CC(=O)c1cc(Cl)c(cc1C)Cl 1P01DEFF [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.232 CC(=O)c1cc(Cl)c(cc1F)Br 1P001RK7 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.232 CC(=O)c1cc(Cl)c(cc1N)Cl 1P006C82 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.232 CC(=O)c1cc(Cl)c(cc1N)F 1P003GQ6 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.232 CC(=O)c1cc(Cl)c(cc1O)C 1P002VY9 [0,2,0,0,0,0|1,0,0]=3 6155 B12R1.232 CC(=O)c1cc(Cl)c(cc1O)Cl 1P00BEUG [0,2,0,0,0,0|1,0,0]=3 6156 B12R1.232 CC(=O)c1cc(F)c(cc1Br)F 1P000XGL [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.232 CC(=O)c1cc(F)c(cc1Br)N 1P01DZ2W [0,2,0,0,0,0|2,0,0]=4 6158 B12R1.232 CC(=O)c1cc(F)c(cc1Cl)Cl 1P003G6X [0,2,0,0,0,0|2,0,0]=4 6159 B12R1.232 CC(=O)c1cc(F)c(cc1Cl)F 1P0016NP [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.232 CC(=O)c1cc(F)c(cc1O)Br 1P00IEKZ [0,2,0,0,0,0|1,0,0]=3 6161 B12R1.232 CC(=O)c1cc(O)c(cc1F)F 1P021VP2 [0,2,0,0,0,0|2,0,0]=4 6162 B12R1.232 Cc1cc(C(=O)C)c(cc1C)C 1P0029P6 [0,2,0,0,0,0|2,0,0]=4 6163 B12R1.232 Cc1cc(C(=O)O)c(cc1Br)C 1P01A4GD [0,2,0,0,0,0|1,0,0]=3 6164 B12R1.232 Cc1cc(C(=O)O)c(cc1C)C 1P003BKS [0,2,0,0,0,0|1,0,0]=3 6165 B12R1.232 Cc1cc(C(=O)O)c(cc1Cl)C 1P01BH7E [0,2,0,0,0,0|1,0,0]=3 6166 B12R1.232 Cc1cc(C(=O)O)c(cc1F)C 1P01KKEP [0,2,0,0,0,0|1,0,0]=3 6167 B12R1.232 Cc1cc(C(=O)O)c(cc1N)C 1P007R8W [0,2,0,0,0,0|1,0,0]=3 6168 B12R1.232 Cc1cc(C(=O)O)c(cc1O)C 1P00BGLN [0,2,0,0,0,0|1,0,0]=3 6169 B12R1.232 Cc1cc(C(=O)O)c(nc1C)C 1P01AC2Z [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.232 Cc1nc(C(=O)O)c(cc1N)C 1P01FITV [0,2,0,0,0,0|2,0,0]=4 6171 B12R1.232 ClC(=O)c1cc(F)c(cc1Br)F 1P008Y2L [0,2,0,0,0,0|2,0,0]=4 6172 B12R1.232 ClC(=O)c1cc(F)c(cc1Cl)Cl 1P003G70 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.232 Clc1cc(C(=O)C)c(cc1C)Cl 1P021GSI [0,2,0,0,0,0|2,0,0]=4 6174 B12R1.232 Clc1cc(C(=O)C)c(cc1Cl)Cl 1P000V68 [0,2,0,0,0,0|2,0,0]=4 6175 B12R1.232 Clc1cc(C(=O)Cl)c(cc1Cl)Cl 1P01FTPS [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.232 Clc1cc(C(=O)N)c(cc1Cl)Cl 1P01JKQ5 [0,2,0,0,0,0|2,0,0]=4 6177 B12R1.232 Clc1cc(C(=O)O)c(cc1Br)Cl 1P004DNA [0,2,0,0,0,0|1,0,0]=3 6178 B12R1.232 Clc1cc(C(=O)O)c(cc1C)Cl 1P00BQ41 [0,2,0,0,0,0|1,0,0]=3 6179 B12R1.232 Clc1cc(C(=O)O)c(cc1Cl)Cl 1P00D9DY [0,2,0,0,0,0|1,0,0]=3 6180 B12R1.232 Clc1cc(C(=O)O)c(cc1F)Cl 1P01AD5Y [0,2,0,0,0,0|1,0,0]=3 6181 B12R1.232 Clc1cc(C(=O)O)c(nc1Cl)Cl 1P00DIEE [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.232 Clc1nc(C(=O)O)c(cc1Cl)Cl 1P00C822 [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.232 Cn1cc(C(=O)O)c(=O)cc1C 1P00I74J [0,2,0,0,0,0|1,0,1]=4 6184 B12R1.232 Fc1cc(C(=O)C)c(cc1Br)F 1P009IZ9 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.232 Fc1cc(C(=O)C)c(cc1F)F 1P00735V [0,2,0,0,0,0|2,0,0]=4 6186 B12R1.232 Fc1cc(C(=O)Cl)c(cc1C)F 1P0085Q1 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.232 Fc1cc(C(=O)Cl)c(cc1Cl)F 1P0011MV [0,2,0,0,0,0|2,0,0]=4 6188 B12R1.232 Fc1cc(C(=O)Cl)c(cc1F)F 1P003G2H [0,2,0,0,0,0|2,0,0]=4 6189 B12R1.232 Fc1cc(C(=O)N)c(cc1Br)F 1P00GNLI [0,2,0,0,0,0|2,0,0]=4 6190 B12R1.232 Fc1cc(C(=O)N)c(cc1Cl)F 1P019CXO [0,2,0,0,0,0|2,0,0]=4 6191 B12R1.232 Fc1cc(C(=O)N)c(cc1F)F 1P006T0U [0,2,0,0,0,0|2,0,0]=4 6192 B12R1.232 Fc1cc(C(=O)O)c(cc1Br)F 1P00C4CT [0,2,0,0,0,0|1,0,0]=3 6193 B12R1.232 Fc1cc(C(=O)O)c(cc1C)F 1P0039GL [0,2,0,0,0,0|1,0,0]=3 6194 B12R1.232 Fc1cc(C(=O)O)c(cc1Cl)F 1P0011MW [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.232 Fc1cc(C(=O)O)c(cc1F)F 1P0033F2 [0,2,0,0,0,0|1,0,0]=3 6196 B12R1.232 Fc1cc(C(=O)O)c(cc1N)F 1P005O74 [0,2,0,0,0,0|1,0,0]=3 6197 B12R1.232 Fc1cc(C(=O)O)c(cc1O)F 1P001ESI [0,2,0,0,0,0|1,0,0]=3 6198 B12R1.232 Fc1cc(C(=O)[O-])c(cc1F)F 1P00DAX5 [0,2,0,0,0,0|1,0,1]=4 6199 B12R1.232 NC(=O)c1cc(Br)c(cc1F)F 1P00I0KW [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.232 NC(=O)c1cc(Br)c(cc1N)F 1P00P6SW [0,2,0,0,0,0|2,0,0]=4 6201 B12R1.232 NC(=O)c1cc(F)c(cc1Cl)Cl 1P003G6Z [0,2,0,0,0,0|2,0,0]=4 6202 B12R1.232 NC(=O)c1cc(F)c(cc1Cl)F 1P00C3U4 [0,2,0,0,0,0|2,0,0]=4 6203 B12R1.232 NC(=O)c1cc(F)c(cc1N)C 1P01AK5H [0,2,0,0,0,0|2,0,0]=4 6204 B12R1.232 NC(=O)c1cc(F)c(cc1N)F 1P01AUTK [0,2,0,0,0,0|2,0,0]=4 6205 B12R1.232 NC(=O)c1cc(N)c(cc1Cl)Cl 1P01BHWY [0,2,0,0,0,0|2,0,0]=4 6206 B12R1.232 NC(=O)c1cc(N)c(cc1F)F 1P019M29 [0,2,0,0,0,0|2,0,0]=4 6207 B12R1.232 NC(=O)c1cc(N)c(cc1F)N 1P028UUW [0,2,0,0,0,0|2,0,0]=4 6208 B12R1.232 OB(c1cc(F)c(cc1O)F)O 1P009XBB [0,2,0,0,0,0|1,0,1]=4 6209 B12R1.232 OC(=O)c1cc(=O)n(cc1Br)C 1P01B5AJ [0,2,0,0,0,0|2,0,0]=4 6210 B12R1.232 OC(=O)c1cc(Br)c(cc1C)C 1P00IMGN [0,2,0,0,0,0|1,0,0]=3 6211 B12R1.232 OC(=O)c1cc(Br)c(cc1C)F 1P00A0L9 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.232 OC(=O)c1cc(Br)c(cc1C)N 1P021WMA [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.232 OC(=O)c1cc(Br)c(cc1Cl)C 1P01E8YR [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.232 OC(=O)c1cc(Br)c(cc1Cl)Cl 1P005C3Y [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.232 OC(=O)c1cc(Br)c(cc1Cl)F 1P0097EE [0,2,0,0,0,0|1,0,0]=3 6216 B12R1.232 OC(=O)c1cc(Br)c(cc1Cl)O 1P01FVZQ [0,2,0,0,0,0|1,0,0]=3 6217 B12R1.232 OC(=O)c1cc(Br)c(cc1F)Br 1P002XHR [0,2,0,0,0,0|1,0,0]=3 6218 B12R1.232 OC(=O)c1cc(Br)c(cc1F)C 1P00I9OH [0,2,0,0,0,0|1,0,0]=3 6219 B12R1.232 OC(=O)c1cc(Br)c(cc1F)Cl 1P002XH1 [0,2,0,0,0,0|1,0,0]=3 6220 B12R1.232 OC(=O)c1cc(Br)c(cc1F)F 1P00C3KJ [0,2,0,0,0,0|1,0,0]=3 6221 B12R1.232 OC(=O)c1cc(Br)c(cc1F)I 1P00ATIC [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.232 OC(=O)c1cc(Br)c(cc1F)N 1P00ATHW [0,2,0,0,0,0|1,0,0]=3 6223 B12R1.232 OC(=O)c1cc(Br)c(cc1F)O 1P00I096 [0,2,0,0,0,0|1,0,0]=3 6224 B12R1.232 OC(=O)c1cc(Br)c(cc1I)Cl 1P00AOGQ [0,2,0,0,0,0|1,0,0]=3 6225 B12R1.232 OC(=O)c1cc(Br)c(cc1I)F 1P021W8I [0,2,0,0,0,0|1,0,0]=3 6226 B12R1.232 OC(=O)c1cc(Br)c(cc1N)Br 1P005RGY [0,2,0,0,0,0|1,0,0]=3 6227 B12R1.232 OC(=O)c1cc(Br)c(cc1N)C 1P0092VP [0,2,0,0,0,0|1,0,0]=3 6228 B12R1.232 OC(=O)c1cc(Br)c(cc1N)Cl 1P00DG45 [0,2,0,0,0,0|1,0,0]=3 6229 B12R1.232 OC(=O)c1cc(Br)c(cc1N)F 1P001J3J [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.232 OC(=O)c1cc(Br)c(cc1O)C 1P00FH6D [0,2,0,0,0,0|0,0,0]=2 6231 B12R1.232 OC(=O)c1cc(Br)c(cc1O)Cl 1P001IC3 [0,2,0,0,0,0|0,0,0]=2 6232 B12R1.232 OC(=O)c1cc(Br)c(cc1O)F 1P001VCP [0,2,0,0,0,0|0,0,0]=2 6233 B12R1.232 OC(=O)c1cc(Br)c(cc1O)O 1P001SB2 [0,2,0,0,0,0|0,0,0]=2 6234 B12R1.232 OC(=O)c1cc(Br)c(cc1O)O 1P003MX7 [0,2,0,0,0,0|0,0,0]=2 6235 B12R1.232 OC(=O)c1cc(Br)c(nc1C)O 1P01BAK5 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.232 OC(=O)c1cc(Br)c(nc1Cl)C 1P009WOE [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.232 OC(=O)c1cc(Br)c(nc1N)Cl 1P0280MY [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.232 OC(=O)c1cc(Br)c(nc1O)C 1P00DKLY [0,2,0,0,0,0|1,0,0]=3 6239 B12R1.232 OC(=O)c1cc(C)c([nH]c1=O)C 1P00D9Q0 [0,2,0,0,0,0|1,0,1]=4 6240 B12R1.232 OC(=O)c1cc(C)c(cc1Br)F 1P00028P [0,2,0,0,0,0|1,0,0]=3 6241 B12R1.232 OC(=O)c1cc(C)c(cc1Cl)Br 1P01FDII [0,2,0,0,0,0|1,0,0]=3 6242 B12R1.232 OC(=O)c1cc(C)c(cc1Cl)C 1P01A2RY [0,2,0,0,0,0|1,0,0]=3 6243 B12R1.232 OC(=O)c1cc(C)c(cc1Cl)Cl 1P00M74D [0,2,0,0,0,0|1,0,0]=3 6244 B12R1.232 OC(=O)c1cc(C)c(cc1Cl)F 1P00BK9F [0,2,0,0,0,0|1,0,0]=3 6245 B12R1.232 OC(=O)c1cc(C)c(cc1Cl)N 1P01EAN1 [0,2,0,0,0,0|1,0,0]=3 6246 B12R1.232 OC(=O)c1cc(C)c(cc1F)Br 1P00C10E [0,2,0,0,0,0|1,0,0]=3 6247 B12R1.232 OC(=O)c1cc(C)c(cc1F)Cl 1P01E6LE [0,2,0,0,0,0|1,0,0]=3 6248 B12R1.232 OC(=O)c1cc(C)c(cc1F)F 1P003G8W [0,2,0,0,0,0|1,0,0]=3 6249 B12R1.232 OC(=O)c1cc(C)c(cc1F)N 1P01FIVU [0,2,0,0,0,0|1,0,0]=3 6250 B12R1.232 OC(=O)c1cc(C)c(cc1I)C 1P00CNG5 [0,2,0,0,0,0|1,0,0]=3 6251 B12R1.232 OC(=O)c1cc(C)c(cc1I)Cl 1P01AM67 [0,2,0,0,0,0|1,0,0]=3 6252 B12R1.232 OC(=O)c1cc(C)c(cc1N)C 1P001NEK [0,2,0,0,0,0|1,0,0]=3 6253 B12R1.232 OC(=O)c1cc(C)c(cc1N)Cl 1P001O5I [0,2,0,0,0,0|1,0,0]=3 6254 B12R1.232 OC(=O)c1cc(C)c(cc1O)F 1P022KXH [0,2,0,0,0,0|0,0,0]=2 6255 B12R1.232 OC(=O)c1cc(C)c(nc1Br)C 1P024KKY [0,2,0,0,0,0|2,0,0]=4 6256 B12R1.232 OC(=O)c1cc(C)c(nc1Cl)C 1P000QIL [0,2,0,0,0,0|2,0,0]=4 6257 B12R1.232 OC(=O)c1cc(C)c(nc1Cl)Cl 1P01R0JZ [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.232 OC(=O)c1cc(C)c(nc1N)C 1P020MMT [0,2,0,0,0,0|2,0,0]=4 6259 B12R1.232 OC(=O)c1cc(Cl)c([nH]c1=O)C 1P000ESO [0,2,0,0,0,0|1,0,1]=4 6260 B12R1.232 OC(=O)c1cc(Cl)c(cc1Br)C 1P01BBK2 [0,2,0,0,0,0|1,0,0]=3 6261 B12R1.232 OC(=O)c1cc(Cl)c(cc1Br)F 1P01BD9P [0,2,0,0,0,0|1,0,0]=3 6262 B12R1.232 OC(=O)c1cc(Cl)c(cc1C)Br 1P01DO1J [0,2,0,0,0,0|1,0,0]=3 6263 B12R1.232 OC(=O)c1cc(Cl)c(cc1C)Cl 1P00I9V2 [0,2,0,0,0,0|1,0,0]=3 6264 B12R1.232 OC(=O)c1cc(Cl)c(cc1C)F 1P023PIZ [0,2,0,0,0,0|1,0,0]=3 6265 B12R1.232 OC(=O)c1cc(Cl)c(cc1C)O 1P01DW47 [0,2,0,0,0,0|1,0,0]=3 6266 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)Br 1P003LFI [0,2,0,0,0,0|1,0,0]=3 6267 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)C 1P000T23 [0,2,0,0,0,0|1,0,0]=3 6268 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)Cl 1P002XHQ [0,2,0,0,0,0|1,0,0]=3 6269 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)F 1P000UDJ [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)I 1P023ZYA [0,2,0,0,0,0|1,0,0]=3 6271 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)N 1P01AM55 [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.232 OC(=O)c1cc(Cl)c(cc1F)O 1P01XBR9 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.232 OC(=O)c1cc(Cl)c(cc1I)F 1P028GED [0,2,0,0,0,0|1,0,0]=3 6274 B12R1.232 OC(=O)c1cc(Cl)c(cc1N)Br 1P001NCF [0,2,0,0,0,0|1,0,0]=3 6275 B12R1.232 OC(=O)c1cc(Cl)c(cc1N)C 1P01KKEJ [0,2,0,0,0,0|1,0,0]=3 6276 B12R1.232 OC(=O)c1cc(Cl)c(cc1N)Cl 1P002JQ3 [0,2,0,0,0,0|1,0,0]=3 6277 B12R1.232 OC(=O)c1cc(Cl)c(cc1N)F 1P00CLEB [0,2,0,0,0,0|1,0,0]=3 6278 B12R1.232 OC(=O)c1cc(Cl)c(cc1O)Cl 1P00DTCP [0,2,0,0,0,0|0,0,0]=2 6279 B12R1.232 OC(=O)c1cc(Cl)c(cc1O)F 1P002INQ [0,2,0,0,0,0|0,0,0]=2 6280 B12R1.232 OC(=O)c1cc(Cl)c(nc1Br)Br 1P00E5LR [0,2,0,0,0,0|2,0,0]=4 6281 B12R1.232 OC(=O)c1cc(Cl)c(nc1C)Cl 1P01AEGN [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.232 OC(=O)c1cc(Cl)c(nc1N)Cl 1P01JUNN [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.232 OC(=O)c1cc(F)c(cc1Br)C 1P00028N [0,2,0,0,0,0|1,0,0]=3 6284 B12R1.232 OC(=O)c1cc(F)c(cc1Br)F 1P003H48 [0,2,0,0,0,0|1,0,0]=3 6285 B12R1.232 OC(=O)c1cc(F)c(cc1Br)O 1P0287SO [0,2,0,0,0,0|1,0,0]=3 6286 B12R1.232 OC(=O)c1cc(F)c(cc1C)Br 1P003AQQ [0,2,0,0,0,0|1,0,0]=3 6287 B12R1.232 OC(=O)c1cc(F)c(cc1C)Cl 1P01KL93 [0,2,0,0,0,0|1,0,0]=3 6288 B12R1.232 OC(=O)c1cc(F)c(cc1C)F 1P0027VZ [0,2,0,0,0,0|1,0,0]=3 6289 B12R1.232 OC(=O)c1cc(F)c(cc1Cl)Br 1P0025TD [0,2,0,0,0,0|1,0,0]=3 6290 B12R1.232 OC(=O)c1cc(F)c(cc1Cl)C 1P003AFZ [0,2,0,0,0,0|1,0,0]=3 6291 B12R1.232 OC(=O)c1cc(F)c(cc1Cl)Cl 1P003BLC [0,2,0,0,0,0|1,0,0]=3 6292 B12R1.232 OC(=O)c1cc(F)c(cc1Cl)F 1P003HD9 [0,2,0,0,0,0|1,0,0]=3 6293 B12R1.232 OC(=O)c1cc(F)c(cc1Cl)N 1P027Y6S [0,2,0,0,0,0|1,0,0]=3 6294 B12R1.232 OC(=O)c1cc(F)c(cc1I)F 1P000UIF [0,2,0,0,0,0|1,0,0]=3 6295 B12R1.232 OC(=O)c1cc(F)c(cc1N)Br 1P001H41 [0,2,0,0,0,0|1,0,0]=3 6296 B12R1.232 OC(=O)c1cc(F)c(cc1N)Br 1P009GHR [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.232 OC(=O)c1cc(F)c(cc1N)C 1P0085PZ [0,2,0,0,0,0|1,0,0]=3 6298 B12R1.232 OC(=O)c1cc(F)c(cc1N)Cl 1P0084BG [0,2,0,0,0,0|1,0,0]=3 6299 B12R1.232 OC(=O)c1cc(F)c(cc1N)F 1P003GV2 [0,2,0,0,0,0|1,0,0]=3 6300 B12R1.232 OC(=O)c1cc(F)c(cc1O)Br 1P01FTPO [0,2,0,0,0,0|0,0,0]=2 6301 B12R1.232 OC(=O)c1cc(F)c(cc1O)C 1P027W33 [0,2,0,0,0,0|0,0,0]=2 6302 B12R1.232 OC(=O)c1cc(F)c(cc1O)F 1P002AM9 [0,2,0,0,0,0|0,0,0]=2 6303 B12R1.232 OC(=O)c1cc(F)c(nc1Cl)Cl 1P003GJS [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.232 OC(=O)c1cc(I)c([nH]c1=O)C 1P021WLU [0,2,0,0,0,0|1,0,1]=4 6305 B12R1.232 OC(=O)c1cc(I)c(cc1C)C 1P005ZG7 [0,2,0,0,0,0|1,0,0]=3 6306 B12R1.232 OC(=O)c1cc(I)c(cc1C)F 1P00ATI6 [0,2,0,0,0,0|1,0,0]=3 6307 B12R1.232 OC(=O)c1cc(I)c(cc1Cl)Cl 1P00IK60 [0,2,0,0,0,0|1,0,0]=3 6308 B12R1.232 OC(=O)c1cc(I)c(cc1Cl)F 1P002TWT [0,2,0,0,0,0|1,0,0]=3 6309 B12R1.232 OC(=O)c1cc(I)c(cc1F)Br 1P01FHVM [0,2,0,0,0,0|1,0,0]=3 6310 B12R1.232 OC(=O)c1cc(I)c(cc1F)C 1P01C3I3 [0,2,0,0,0,0|1,0,0]=3 6311 B12R1.232 OC(=O)c1cc(I)c(cc1F)F 1P001W4D [0,2,0,0,0,0|1,0,0]=3 6312 B12R1.232 OC(=O)c1cc(I)c(cc1N)F 1P00BIIR [0,2,0,0,0,0|1,0,0]=3 6313 B12R1.232 OC(=O)c1cc(I)c(cc1O)O 1P01DJ77 [0,2,0,0,0,0|0,0,0]=2 6314 B12R1.232 OC(=O)c1cc(N)c(cc1Br)C 1P005X55 [0,2,0,0,0,0|1,0,0]=3 6315 B12R1.232 OC(=O)c1cc(N)c(cc1Br)Cl 1P01FDVZ [0,2,0,0,0,0|1,0,0]=3 6316 B12R1.232 OC(=O)c1cc(N)c(cc1C)Br 1P00HVBS [0,2,0,0,0,0|1,0,0]=3 6317 B12R1.232 OC(=O)c1cc(N)c(cc1C)C 1P002P4L [0,2,0,0,0,0|1,0,0]=3 6318 B12R1.232 OC(=O)c1cc(N)c(cc1C)F 1P01BDXY [0,2,0,0,0,0|1,0,0]=3 6319 B12R1.232 OC(=O)c1cc(N)c(cc1Cl)C 1P00A197 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.232 OC(=O)c1cc(N)c(cc1Cl)Cl 1P00APW4 [0,2,0,0,0,0|1,0,0]=3 6321 B12R1.232 OC(=O)c1cc(N)c(cc1Cl)F 1P00AOF3 [0,2,0,0,0,0|1,0,0]=3 6322 B12R1.232 OC(=O)c1cc(N)c(cc1F)F 1P00EIW6 [0,2,0,0,0,0|1,0,0]=3 6323 B12R1.232 OC(=O)c1cc(N)c(cc1F)N 1P01A789 [0,2,0,0,0,0|1,0,0]=3 6324 B12R1.232 OC(=O)c1cc(N)c(cc1F)O 1P00HYV2 [0,2,0,0,0,0|1,0,0]=3 6325 B12R1.232 OC(=O)c1cc(N)c(cc1O)O 1P0065KW [0,2,0,0,0,0|0,0,0]=2 6326 B12R1.232 OC(=O)c1cc(O)c(cc1C)O 1P01RJK3 [0,2,0,0,0,0|1,0,0]=3 6327 B12R1.232 OC(=O)c1cc(O)c(cc1F)C 1P004KJP [0,2,0,0,0,0|1,0,0]=3 6328 B12R1.232 OC(=O)c1cc(O)c(cc1N)F 1P00A17M [0,2,0,0,0,0|1,0,0]=3 6329 B12R1.232 OC(=O)c1cc(O)c(cc1N)O 1P000FU8 [0,2,0,0,0,0|1,0,0]=3 6330 B12R1.232 OC(=O)c1cc(S)c(cc1F)C 1P01ME74 [0,2,0,0,0,0|1,0,0]=3 6331 B12R1.232 OC(=O)c1cn(C)c(=O)cc1C 1P028WSM [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.232 OC(=O)c1nc(Br)c(cc1Cl)C 1P0290IF [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.232 OC(=O)c1nc(Br)c(cc1Cl)F 1P00I9O8 [0,2,0,0,0,0|2,0,0]=4 6334 B12R1.232 OC(=O)c1nc(Br)c(cc1F)C 1P028E04 [0,2,0,0,0,0|2,0,0]=4 6335 B12R1.232 OC(=O)c1nc(C)c(cc1Br)C 1P028R3P [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.232 OC(=O)c1nc(C)c(cc1N)C 1P0284BL [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.232 OC(=O)c1nc(Cl)c(cc1Br)C 1P027XLV [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.232 OC(=O)c1nc(Cl)c(cc1F)C 1P0284L2 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.232 Oc1cc(C(=O)C)c(cc1O)O 1P0023L1 [0,2,0,0,0,0|1,0,0]=3 6340 B12R1.232 [O-]C(=O)c1cc(F)c(cc1Cl)F 1P001ICJ [0,2,0,0,0,0|1,0,1]=4 6341 B12R1.232 [O-][N+](=O)c1cc(Br)c(cc1O)C 1P0024EW [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.232 [O-][N+](=O)c1cc(Br)c(cc1O)F 1P0005GM [0,2,0,0,0,0|1,0,1]=4 6343 B12R1.232 [O-][N+](=O)c1cc(C)c(cc1O)Br 1P01FH2T [0,2,0,0,0,0|1,0,1]=4 6344 B12R1.232 [O-][N+](=O)c1cc(C)c(cc1O)Cl 1P0001WW [0,2,0,0,0,0|1,0,1]=4 6345 B12R1.232 [O-][N+](=O)c1cc(C)c(cc1O)F 1P004XPT [0,2,0,0,0,0|1,0,1]=4 6346 B12R1.232 [O-][N+](=O)c1cc(Cl)c(cc1O)Br 1P004V7P [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.232 [O-][N+](=O)c1cc(Cl)c(cc1O)C 1P003LMK [0,2,0,0,0,0|1,0,1]=4 6348 B12R1.232 [O-][N+](=O)c1cc(Cl)c(cc1O)Cl 1P00C959 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.232 [O-][N+](=O)c1cc(Cl)c(cc1O)F 1P00CM22 [0,2,0,0,0,0|1,0,1]=4 6350 B12R1.232 [O-][N+](=O)c1cc(F)c(cc1O)Br 1P00IIO7 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.232 [O-][N+](=O)c1cc(F)c(cc1O)C 1P00IUOE [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.232 [O-][N+](=O)c1cc(F)c(cc1O)Cl 1P00EIT1 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.232 [O-][N+](=O)c1cc(F)c(cc1O)F 1P00DE7Q [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.232 [O-][N+](=O)c1cc(N)c(cc1O)O 1P00478F [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.452 BrCc1ccc(c(c1)Cl)C(=O)O 1P00BLZG [0,2,0,0,0,0|1,0,0]=3 6356 B12R1.452 BrCc1ccc(c(c1)F)C(=O)O 1P00DLTO [0,2,0,0,0,0|1,0,0]=3 6357 B12R1.452 BrCc1ccc(c(c1)O)[N+](=O)[O-] 1P002TG5 [0,2,0,0,0,0|1,0,1]=4 6358 B12R1.452 C#Cc1ccc(c(c1)C)C(=O)O 1P01T2S9 [0,2,0,0,0,0|1,0,0]=3 6359 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)O 1P01D9LG [0,2,0,0,0,0|1,0,0]=3 6360 B12R1.452 C#Cc1ccc(c(c1)N)C(=O)O 1P025GBB [0,2,0,0,0,0|1,0,0]=3 6361 B12R1.452 C#Cc1cnc(c(c1)C)C(=O)O 1P028GP0 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.452 CCc1ccc(c(c1)C)C(=O)O 1P01KYHS [0,2,0,0,0,0|1,0,0]=3 6363 B12R1.452 CCc1ccc(c(c1)Cl)C(=O)O 1P021OSB [0,2,0,0,0,0|1,0,0]=3 6364 B12R1.452 CCc1ccc(c(c1)F)C(=O)N 1P01JWM4 [0,2,0,0,0,0|2,0,0]=4 6365 B12R1.452 CCc1ccc(c(c1)F)C(=O)O 1P00I7SR [0,2,0,0,0,0|1,0,0]=3 6366 B12R1.452 CCc1ccc(c(c1)N)C(=O)O 1P01PTS9 [0,2,0,0,0,0|1,0,0]=3 6367 B12R1.452 CCc1ccc(c(c1)O)C(=O)O 1P002LTL [0,2,0,0,0,0|0,0,0]=2 6368 B12R1.452 CCc1ccc(c(n1)Br)C(=O)O 1P01BJT8 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.452 CCc1ccc(c(n1)C)C(=O)O 1P01AC74 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.452 CCc1ccc(c(n1)C)C(=O)O 1P028P65 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.452 CNc1ccc(c(c1)Br)C(=O)N 1P0287PO [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)O 1P00C9HE [0,2,0,0,0,0|1,0,0]=3 6373 B12R1.452 COc1ccc(c(=O)[nH]1)C(=O)O 1P01KKWN [0,2,0,0,0,0|1,0,1]=4 6374 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1P0043DU [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.452 COc1ccc(c(c1)Br)C(=O)O 1P0033M4 [0,2,0,0,0,0|1,0,0]=3 6376 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1P00C40K [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.452 COc1ccc(c(c1)C)C(=O)O 1P0034JW [0,2,0,0,0,0|1,0,0]=3 6378 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1P0073TC [0,2,0,0,0,0|2,0,0]=4 6379 B12R1.452 COc1ccc(c(c1)Cl)C(=O)O 1P0039C7 [0,2,0,0,0,0|1,0,0]=3 6380 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1P0033RR [0,2,0,0,0,0|2,0,0]=4 6381 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl 1P00C0QM [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.452 COc1ccc(c(c1)F)C(=O)O 1P003HQ4 [0,2,0,0,0,0|1,0,0]=3 6383 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1P021WL3 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.452 COc1ccc(c(c1)I)C(=O)O 1P00DICA [0,2,0,0,0,0|1,0,0]=3 6385 B12R1.452 COc1ccc(c(c1)N)C(=O)C 1P00BXTU [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.452 COc1ccc(c(c1)N)C(=O)N 1P00C7F3 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.452 COc1ccc(c(c1)N)C(=O)O 1P0037WF [0,2,0,0,0,0|1,0,0]=3 6388 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1P0033T0 [0,2,0,0,0,0|1,0,0]=3 6389 B12R1.452 COc1ccc(c(c1)O)C(=O)N 1P003M5R [0,2,0,0,0,0|1,0,0]=3 6390 B12R1.452 COc1ccc(c(c1)O)C(=O)O 1P003M5S [0,2,0,0,0,0|0,0,0]=2 6391 B12R1.452 COc1ccc(c(c1)O)C(=O)[O-] 1P006UK5 [0,2,0,0,0,0|0,0,1]=3 6392 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] 1P003NAQ [0,2,0,0,0,0|1,0,1]=4 6393 B12R1.452 COc1ccc(c(n1)Br)C(=O)O 1P0003TC [0,2,0,0,0,0|2,0,0]=4 6394 B12R1.452 COc1ccc(c(n1)C)C(=O)O 1P000JRD [0,2,0,0,0,0|2,0,0]=4 6395 B12R1.452 COc1ccc(c(n1)Cl)C(=O)O 1P0037U5 [0,2,0,0,0,0|2,0,0]=4 6396 B12R1.452 COc1ccc(c(n1)F)C(=O)O 1P009A9R [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.452 COc1ccc(c(n1)N)C(=O)O 1P000PT5 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.452 COc1cnc(c(c1)C)C(=O)O 1P00HIUU [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.452 COc1cnc(c(c1)Cl)C(=O)O 1P000Y7U [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.452 COc1cnc(c(c1)F)C(=O)O 1P000JQB [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.452 COc1cnc(c(c1)N)C(=O)O 1P01K9LZ [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.452 COc1ncc(c(c1)C)C(=O)O 1P00IIJZ [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.452 COc1ncc(c(c1)Cl)C(=O)O 1P0099O6 [0,2,0,0,0,0|2,0,0]=4 6404 B12R1.452 COc1ncc(c(c1)N)C(=O)O 1P0092Z3 [0,2,0,0,0,0|2,0,0]=4 6405 B12R1.452 CSc1ccc(c(c1)C)C(=O)O 1P00HFAC [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.452 CSc1ccc(c(c1)Cl)C(=O)C 1P019YLK [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.452 CSc1ccc(c(c1)Cl)C(=O)O 1P01DVF2 [0,2,0,0,0,0|1,0,0]=3 6408 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 1P01BKX8 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.452 CSc1ncc(c(n1)O)C(=O)O 1P0077X3 [0,2,0,0,0,0|2,0,0]=4 6410 B12R1.452 ClCc1ccc(c(c1)F)C(=O)O 1P01B2ES [0,2,0,0,0,0|1,0,0]=3 6411 B12R1.452 N#Cc1ccc(c(=O)[nH]1)C(=O)O 1P01BK1L [0,2,0,0,0,0|1,0,1]=4 6412 B12R1.452 N#Cc1ccc(c(c1)Br)C(=O)O 1P00IJPW [0,2,0,0,0,0|1,0,0]=3 6413 B12R1.452 N#Cc1ccc(c(c1)C)C(=O)C 1P00DOQY [0,2,0,0,0,0|2,0,0]=4 6414 B12R1.452 N#Cc1ccc(c(c1)C)C(=O)O 1P002BB6 [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.452 N#Cc1ccc(c(c1)Cl)C(=O)O 1P0033OG [0,2,0,0,0,0|1,0,0]=3 6416 B12R1.452 N#Cc1ccc(c(c1)F)C(=O)C 1P01A64A [0,2,0,0,0,0|2,0,0]=4 6417 B12R1.452 N#Cc1ccc(c(c1)F)C(=O)O 1P001V4Q [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.452 N#Cc1ccc(c(c1)I)C(=O)O 1P000RUB [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.452 N#Cc1ccc(c(c1)N)C(=O)O 1P00ELTV [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.452 N#Cc1ccc(c(c1)O)C(=O)O 1P003A7F [0,2,0,0,0,0|0,0,0]=2 6421 B12R1.452 N#Cc1ccc(c(c1)O)[N+](=O)[O-] 1P00AQL9 [0,2,0,0,0,0|1,0,1]=4 6422 B12R1.452 N#Cc1ccc(c(n1)C)C(=O)O 1P01DZGC [0,2,0,0,0,0|2,0,0]=4 6423 B12R1.452 N#Cc1ccc(c(n1)Cl)C(=O)O 1P01DWDK [0,2,0,0,0,0|2,0,0]=4 6424 B12R1.452 N#Cc1cnc(c(c1)C)C(=O)O 1P00A0LC [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.452 N#Cc1cnc(c(c1)Cl)C(=O)O 1P000QN9 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.452 N#Cc1ncc(c(c1)C)C(=O)O 1P01ELH4 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.452 NCc1ccc(c(c1)C)C(=O)O 1P01C1X0 [0,2,0,0,0,0|1,0,0]=3 6428 B12R1.452 NCc1ccc(c(c1)Cl)C(=O)O 1P01JNAK [0,2,0,0,0,0|1,0,0]=3 6429 B12R1.452 NCc1ccc(c(c1)O)C(=O)O 1P0280TB [0,2,0,0,0,0|0,0,0]=2 6430 B12R1.452 NCc1ccc(c(n1)C)C(=O)O 1P01A3XN [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.452 NNc1ccc(c(c1)Cl)C(=O)O 1P00CNV6 [0,2,0,0,0,0|1,0,0]=3 6432 B12R1.452 NNc1ccc(c(c1)F)C(=O)O 1P01AV0W [0,2,0,0,0,0|1,0,0]=3 6433 B12R1.452 NNc1ccc(c(c1)O)[N+](=O)[O-] 1P028VOO [0,2,0,0,0,0|1,0,1]=4 6434 B12R1.452 NNc1ccc(c(c1)S)C(=O)O 1P028PIM [0,2,0,0,0,0|0,1,0]=3 6435 B12R1.452 O=Cc1ccc(c(c1)C)C(=O)O 1P00DLI1 [0,2,0,0,0,0|1,0,0]=3 6436 B12R1.452 O=Cc1ccc(c(c1)Cl)C(=O)O 1P009YIW [0,2,0,0,0,0|1,0,0]=3 6437 B12R1.452 O=Cc1ccc(c(c1)F)C(=O)O 1P00IB5P [0,2,0,0,0,0|1,0,0]=3 6438 B12R1.452 O=Cc1ccc(c(c1)O)C(=O)O 1P00DIFQ [0,2,0,0,0,0|0,0,0]=2 6439 B12R1.452 O=Cc1ccc(c(c1)O)[N+](=O)[O-] 1P005VMS [0,2,0,0,0,0|1,0,1]=4 6440 B12R1.452 O=Cc1cnc(c(c1)Cl)C(=O)O 1P02925T [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.452 OCc1ccc(c(c1)Cl)C(=O)O 1P01DZYZ [0,2,0,0,0,0|1,0,0]=3 6442 B12R1.452 OCc1ccc(c(c1)F)C(=O)O 1P003HPR [0,2,0,0,0,0|1,0,0]=3 6443 B12R1.452 OCc1ccc(c(c1)O)[N+](=O)[O-] 1P00ECT9 [0,2,0,0,0,0|1,0,1]=4 6444 B12R1.452 OCc1cnc(c(c1)Cl)C(=O)O 1P027UAA [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.1703 BrCC(=O)c1ccc(cc1C)C 1P002TB7 [0,2,0,0,0,0|2,0,0]=4 6446 B12R1.1703 BrCC(=O)c1ccc(cc1Cl)Cl 1P002T4T [0,2,0,0,0,0|2,0,0]=4 6447 B12R1.1703 BrCC(=O)c1ccc(cc1Cl)F 1P00EL66 [0,2,0,0,0,0|2,0,0]=4 6448 B12R1.1703 BrCC(=O)c1ccc(cc1F)Br 1P008EOG [0,2,0,0,0,0|2,0,0]=4 6449 B12R1.1703 BrCC(=O)c1ccc(cc1F)Cl 1P019EAR [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.1703 BrCC(=O)c1ccc(cc1F)F 1P0007WL [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.1703 BrCC(=O)c1ccc(cc1I)Br 1P01B9JN [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.1703 BrCC(=O)c1ccc(cc1O)F 1P01FLMI [0,2,0,0,0,0|1,0,0]=3 6453 B12R1.1703 BrCC(=O)c1ccc(cc1O)O 1P002QB2 [0,2,0,0,0,0|1,0,0]=3 6454 B12R1.1703 C#CC(=O)c1ccc(cc1F)Br 1P01BI4X [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1P00FM7G [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1P00C8SM [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1P01BGE0 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1P001X9P [0,2,0,0,0,0|2,0,0]=4 6459 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1P003G8A [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1P002RPL [0,2,0,0,0,0|2,0,0]=4 6461 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1P00I2AQ [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1P003BLJ [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1P01BGF6 [0,2,0,0,0,0|1,0,0]=3 6464 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1P01BAZQ [0,2,0,0,0,0|1,0,0]=3 6465 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1P003G9Z [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1P00N1PM [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1P0068G8 [0,2,0,0,0,0|2,0,0]=4 6468 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1P01A55F [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.1703 CNC(=O)c1ccc(cc1C)N 1P01NW4B [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.1703 CNC(=O)c1ccc(cc1Cl)N 1P00IHP6 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1P008OV4 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1P00HTQZ [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1P009JQ5 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.1703 CNC(=O)c1ccc(cc1F)N 1P00GSCO [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.1703 CNC(=O)c1ccc(cc1N)Cl 1P007XZZ [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 1P028065 [0,2,0,0,0,0|1,0,0]=3 6477 B12R1.1703 COC(=N)c1ccc(cc1Cl)Cl 1P01FLEM [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.1703 COC(=O)c1c[nH]c(=O)cc1C 1P00HH6W [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.1703 COC(=O)c1ccc(=N)[nH]c1C 1P00GTX5 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.1703 COC(=O)c1ccc(=O)[nH]c1C 1P003S5E [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.1703 COC(=O)c1ccc([nH]c1=O)Br 1P01KKXX [0,2,0,0,0,0|1,0,1]=4 6482 B12R1.1703 COC(=O)c1ccc([nH]c1=O)C 1P00DKM4 [0,2,0,0,0,0|1,0,1]=4 6483 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])Br 1P01KLRT [0,2,0,0,0,0|1,0,1]=4 6484 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])C 1P00CNSN [0,2,0,0,0,0|1,0,1]=4 6485 B12R1.1703 COC(=O)c1ccc(cc1Br)Br 1P00DFAM [0,2,0,0,0,0|1,0,0]=3 6486 B12R1.1703 COC(=O)c1ccc(cc1Br)C 1P003S3S [0,2,0,0,0,0|1,0,0]=3 6487 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl 1P0037HV [0,2,0,0,0,0|1,0,0]=3 6488 B12R1.1703 COC(=O)c1ccc(cc1Br)F 1P0035MH [0,2,0,0,0,0|1,0,0]=3 6489 B12R1.1703 COC(=O)c1ccc(cc1Br)I 1P01K5GJ [0,2,0,0,0,0|1,0,0]=3 6490 B12R1.1703 COC(=O)c1ccc(cc1Br)N 1P00IKL1 [0,2,0,0,0,0|1,0,0]=3 6491 B12R1.1703 COC(=O)c1ccc(cc1Br)O 1P00046Z [0,2,0,0,0,0|1,0,0]=3 6492 B12R1.1703 COC(=O)c1ccc(cc1C)Br 1P003SBE [0,2,0,0,0,0|1,0,0]=3 6493 B12R1.1703 COC(=O)c1ccc(cc1C)C 1P002ODH [0,2,0,0,0,0|1,0,0]=3 6494 B12R1.1703 COC(=O)c1ccc(cc1C)Cl 1P00IKRY [0,2,0,0,0,0|1,0,0]=3 6495 B12R1.1703 COC(=O)c1ccc(cc1C)F 1P002043 [0,2,0,0,0,0|1,0,0]=3 6496 B12R1.1703 COC(=O)c1ccc(cc1C)I 1P007H5H [0,2,0,0,0,0|1,0,0]=3 6497 B12R1.1703 COC(=O)c1ccc(cc1C)N 1P00ICE1 [0,2,0,0,0,0|1,0,0]=3 6498 B12R1.1703 COC(=O)c1ccc(cc1C)O 1P00IAPT [0,2,0,0,0,0|1,0,0]=3 6499 B12R1.1703 COC(=O)c1ccc(cc1Cl)Br 1P003LCZ [0,2,0,0,0,0|1,0,0]=3 6500 B12R1.1703 COC(=O)c1ccc(cc1Cl)C 1P0074SD [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl 1P003SJW [0,2,0,0,0,0|1,0,0]=3 6502 B12R1.1703 COC(=O)c1ccc(cc1Cl)F 1P003S3Y [0,2,0,0,0,0|1,0,0]=3 6503 B12R1.1703 COC(=O)c1ccc(cc1Cl)I 1P001P9V [0,2,0,0,0,0|1,0,0]=3 6504 B12R1.1703 COC(=O)c1ccc(cc1Cl)N 1P003SB3 [0,2,0,0,0,0|1,0,0]=3 6505 B12R1.1703 COC(=O)c1ccc(cc1Cl)N 1P01CAQL [0,2,0,0,0,0|1,0,0]=3 6506 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 1P007YQ3 [0,2,0,0,0,0|1,0,0]=3 6507 B12R1.1703 COC(=O)c1ccc(cc1F)Br 1P0027CD [0,2,0,0,0,0|1,0,0]=3 6508 B12R1.1703 COC(=O)c1ccc(cc1F)C 1P00FH6Q [0,2,0,0,0,0|1,0,0]=3 6509 B12R1.1703 COC(=O)c1ccc(cc1F)Cl 1P001LPR [0,2,0,0,0,0|1,0,0]=3 6510 B12R1.1703 COC(=O)c1ccc(cc1F)F 1P007V2R [0,2,0,0,0,0|1,0,0]=3 6511 B12R1.1703 COC(=O)c1ccc(cc1F)I 1P0029TN [0,2,0,0,0,0|1,0,0]=3 6512 B12R1.1703 COC(=O)c1ccc(cc1F)N 1P008QHI [0,2,0,0,0,0|1,0,0]=3 6513 B12R1.1703 COC(=O)c1ccc(cc1F)N 1P01BKQ5 [0,2,0,0,0,0|1,0,0]=3 6514 B12R1.1703 COC(=O)c1ccc(cc1F)O 1P002BBR [0,2,0,0,0,0|1,0,0]=3 6515 B12R1.1703 COC(=O)c1ccc(cc1I)Br 1P00942A [0,2,0,0,0,0|1,0,0]=3 6516 B12R1.1703 COC(=O)c1ccc(cc1I)C 1P007H5G [0,2,0,0,0,0|1,0,0]=3 6517 B12R1.1703 COC(=O)c1ccc(cc1I)Cl 1P0023KA [0,2,0,0,0,0|1,0,0]=3 6518 B12R1.1703 COC(=O)c1ccc(cc1I)F 1P01DU8L [0,2,0,0,0,0|1,0,0]=3 6519 B12R1.1703 COC(=O)c1ccc(cc1I)N 1P006RQV [0,2,0,0,0,0|1,0,0]=3 6520 B12R1.1703 COC(=O)c1ccc(cc1N)Br 1P0039EI [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.1703 COC(=O)c1ccc(cc1N)C 1P007T8S [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.1703 COC(=O)c1ccc(cc1N)Cl 1P003GVP [0,2,0,0,0,0|1,0,0]=3 6523 B12R1.1703 COC(=O)c1ccc(cc1N)F 1P002PS7 [0,2,0,0,0,0|1,0,0]=3 6524 B12R1.1703 COC(=O)c1ccc(cc1N)I 1P001K7E [0,2,0,0,0,0|1,0,0]=3 6525 B12R1.1703 COC(=O)c1ccc(cc1N)O 1P00I8C9 [0,2,0,0,0,0|1,0,0]=3 6526 B12R1.1703 COC(=O)c1ccc(cc1O)Br 1P006XDA [0,2,0,0,0,0|0,0,0]=2 6527 B12R1.1703 COC(=O)c1ccc(cc1O)C 1P003S4S [0,2,0,0,0,0|0,0,0]=2 6528 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 1P0035O9 [0,2,0,0,0,0|0,0,0]=2 6529 B12R1.1703 COC(=O)c1ccc(cc1O)F 1P0035OA [0,2,0,0,0,0|0,0,0]=2 6530 B12R1.1703 COC(=O)c1ccc(cc1O)I 1P0023KF [0,2,0,0,0,0|0,0,0]=2 6531 B12R1.1703 COC(=O)c1ccc(cc1O)N 1P0035NY [0,2,0,0,0,0|0,0,0]=2 6532 B12R1.1703 COC(=O)c1ccc(cc1O)O 1P0033G7 [0,2,0,0,0,0|0,0,0]=2 6533 B12R1.1703 COC(=O)c1ccc(cc1S)Cl 1P01BTY8 [0,2,0,0,0,0|0,1,0]=3 6534 B12R1.1703 COC(=O)c1ccc(cc1S)F 1P01A4YE [0,2,0,0,0,0|0,1,0]=3 6535 B12R1.1703 COC(=O)c1ccc(nc1Br)C 1P0089RN [0,2,0,0,0,0|2,0,0]=4 6536 B12R1.1703 COC(=O)c1ccc(nc1Br)Cl 1P0015AU [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.1703 COC(=O)c1ccc(nc1Br)F 1P01BV4T [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.1703 COC(=O)c1ccc(nc1Br)N 1P0203Z6 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.1703 COC(=O)c1ccc(nc1C)Br 1P00A1IO [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.1703 COC(=O)c1ccc(nc1C)C 1P009ELK [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.1703 COC(=O)c1ccc(nc1C)Cl 1P00GAKT [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.1703 COC(=O)c1ccc(nc1C)F 1P000JTT [0,2,0,0,0,0|2,0,0]=4 6543 B12R1.1703 COC(=O)c1ccc(nc1Cl)Br 1P000BBB [0,2,0,0,0,0|2,0,0]=4 6544 B12R1.1703 COC(=O)c1ccc(nc1Cl)C 1P00D9EY [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.1703 COC(=O)c1ccc(nc1Cl)Cl 1P0035MB [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.1703 COC(=O)c1ccc(nc1Cl)N 1P0002FB [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.1703 COC(=O)c1ccc(nc1Cl)O 1P00I0L2 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.1703 COC(=O)c1ccc(nc1F)Br 1P01KZB7 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.1703 COC(=O)c1ccc(nc1F)Cl 1P0099SS [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.1703 COC(=O)c1ccc(nc1F)F 1P00781H [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.1703 COC(=O)c1ccc(nc1F)N 1P01XC28 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.1703 COC(=O)c1ccc(nc1N)Br 1P01C6YW [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.1703 COC(=O)c1ccc(nc1N)C 1P01BEIX [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.1703 COC(=O)c1ccc(nc1N)Cl 1P004UYA [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.1703 COC(=O)c1ccc(nc1N)F 1P01V5WF [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.1703 COC(=O)c1ccc(nc1N)O 1P0292XR [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.1703 COC(=O)c1ccc(nc1O)C 1P01FIA6 [0,2,0,0,0,0|1,0,0]=3 6558 B12R1.1703 COC(=O)c1cnc(cc1Br)Br 1P0012C3 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.1703 COC(=O)c1cnc(cc1Br)C 1P00GSL8 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.1703 COC(=O)c1cnc(cc1Br)Cl 1P009HDG [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.1703 COC(=O)c1cnc(cc1Br)F 1P028DD8 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.1703 COC(=O)c1cnc(cc1C)Br 1P01DDH7 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.1703 COC(=O)c1cnc(cc1C)C 1P005H3L [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.1703 COC(=O)c1cnc(cc1C)Cl 1P0017P3 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.1703 COC(=O)c1cnc(cc1C)F 1P01BTWD [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.1703 COC(=O)c1cnc(cc1C)N 1P01AUT6 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.1703 COC(=O)c1cnc(cc1Cl)Br 1P000OU9 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.1703 COC(=O)c1cnc(cc1Cl)C 1P0049JC [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.1703 COC(=O)c1cnc(cc1Cl)Cl 1P00390L [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.1703 COC(=O)c1cnc(cc1Cl)N 1P000RGV [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.1703 COC(=O)c1cnc(cc1F)Cl 1P01B27J [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.1703 COC(=O)c1cnc(cc1F)F 1P0022NN [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.1703 COC(=O)c1cnc(cc1N)C 1P00GSJ6 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.1703 COC(=O)c1cnc(cc1N)Cl 1P000OTC [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.1703 COC(=O)c1cnc(cc1N)F 1P00OEMM [0,2,0,0,0,0|2,0,0]=4 6576 B12R1.1703 COC(=O)c1cnc(cc1O)O 1P0052HO [0,2,0,0,0,0|1,0,0]=3 6577 B12R1.1703 COC(=O)c1cnc(nc1O)C 1P00H419 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.1703 COC(=O)c1ncc(cc1Br)C 1P000K5L [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.1703 COC(=O)c1ncc(cc1Br)Cl 1P0015DK [0,2,0,0,0,0|2,0,0]=4 6580 B12R1.1703 COC(=O)c1ncc(cc1Br)F 1P0015AG [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.1703 COC(=O)c1ncc(cc1C)Br 1P0038NJ [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.1703 COC(=O)c1ncc(cc1C)F 1P009YU1 [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.1703 COC(=O)c1ncc(cc1C)I 1P028T39 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.1703 COC(=O)c1ncc(cc1C)N 1P00HRX3 [0,2,0,0,0,0|2,0,0]=4 6585 B12R1.1703 COC(=O)c1ncc(cc1C)O 1P00HGEA [0,2,0,0,0,0|2,0,0]=4 6586 B12R1.1703 COC(=O)c1ncc(cc1Cl)Br 1P0015AL [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.1703 COC(=O)c1ncc(cc1Cl)Cl 1P00IA6J [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.1703 COC(=O)c1ncc(cc1Cl)F 1P0015FX [0,2,0,0,0,0|2,0,0]=4 6589 B12R1.1703 COC(=O)c1ncc(cc1Cl)N 1P000OXL [0,2,0,0,0,0|2,0,0]=4 6590 B12R1.1703 COC(=O)c1ncc(cc1Cl)N 1P01BAQ5 [0,2,0,0,0,0|2,0,0]=4 6591 B12R1.1703 COC(=O)c1ncc(cc1Cl)O 1P000OV8 [0,2,0,0,0,0|2,0,0]=4 6592 B12R1.1703 COC(=O)c1ncc(cc1F)Br 1P009DBE [0,2,0,0,0,0|2,0,0]=4 6593 B12R1.1703 COC(=O)c1ncc(cc1F)Cl 1P000QN8 [0,2,0,0,0,0|2,0,0]=4 6594 B12R1.1703 COC(=O)c1ncc(cc1F)F 1P00IJO3 [0,2,0,0,0,0|2,0,0]=4 6595 B12R1.1703 COC(=O)c1ncc(cc1F)N 1P00A0MI [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.1703 COC(=O)c1ncc(cc1F)O 1P000OXZ [0,2,0,0,0,0|2,0,0]=4 6597 B12R1.1703 COC(=O)c1ncc(cc1N)Br 1P008ULL [0,2,0,0,0,0|2,0,0]=4 6598 B12R1.1703 COC(=O)c1ncc(cc1N)C 1P01XAC2 [0,2,0,0,0,0|2,0,0]=4 6599 B12R1.1703 COC(=O)c1ncc(cc1N)Cl 1P00IEN1 [0,2,0,0,0,0|2,0,0]=4 6600 B12R1.1703 COC(=O)c1ncc(cc1N)F 1P00HB3E [0,2,0,0,0,0|2,0,0]=4 6601 B12R1.1703 COC(=O)c1ncc(cc1N)F 1P02829Z [0,2,0,0,0,0|2,0,0]=4 6602 B12R1.1703 COC(=O)c1ncc(cc1O)Br 1P000M64 [0,2,0,0,0,0|1,0,0]=3 6603 B12R1.1703 COC(=O)c1nnc(cc1O)O 1P00CJ9F [0,2,0,0,0,0|2,0,0]=4 6604 B12R1.1703 ClCC(=O)c1ccc(cc1C)C 1P002SU7 [0,2,0,0,0,0|2,0,0]=4 6605 B12R1.1703 ClCC(=O)c1ccc(cc1Cl)Cl 1P0033D1 [0,2,0,0,0,0|2,0,0]=4 6606 B12R1.1703 ClCC(=O)c1ccc(cc1F)Cl 1P00C5NR [0,2,0,0,0,0|2,0,0]=4 6607 B12R1.1703 ClCC(=O)c1ccc(cc1F)F 1P0033NS [0,2,0,0,0,0|2,0,0]=4 6608 B12R1.1703 ClCC(=O)c1ccc(cc1O)O 1P002QN2 [0,2,0,0,0,0|1,0,0]=3 6609 B12R1.1703 FCC(=O)c1ccc(cc1F)F 1P00CU6O [0,2,0,0,0,0|2,0,0]=4 6610 B12R1.1703 N#CC(=O)c1ccc(cc1Cl)Cl 1P00CAEF [0,2,0,0,0,0|2,0,0]=4 6611 B12R1.1703 NC1=CC(=C(C=N1)C(=O)OC)Br 1P01JHXB [0,2,0,0,0,0|2,0,0]=4 6612 B12R1.1703 NCC(=O)c1ccc(cc1Br)F 1P028AEW [0,2,0,0,0,0|2,0,0]=4 6613 B12R1.1703 NCC(=O)c1ccc(cc1Cl)Cl 1P00EG06 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.1703 NCC(=O)c1ccc(cc1Cl)F 1P01BY0G [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.1703 NCC(=O)c1ccc(cc1F)Br 1P023R3T [0,2,0,0,0,0|2,0,0]=4 6616 B12R1.1703 NCC(=O)c1ccc(cc1F)Cl 1P01BXWE [0,2,0,0,0,0|2,0,0]=4 6617 B12R1.1703 NCC(=O)c1ccc(cc1F)F 1P005988 [0,2,0,0,0,0|2,0,0]=4 6618 B12R1.1703 NNC(=O)c1ccc(cc1Br)F 1P019WAW [0,2,0,0,0,0|2,0,0]=4 6619 B12R1.1703 NNC(=O)c1ccc(cc1C)Br 1P0283EM [0,2,0,0,0,0|2,0,0]=4 6620 B12R1.1703 NNC(=O)c1ccc(cc1C)C 1P004PPE [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.1703 NNC(=O)c1ccc(cc1C)Cl 1P0036ZX [0,2,0,0,0,0|2,0,0]=4 6622 B12R1.1703 NNC(=O)c1ccc(cc1Cl)Br 1P002J14 [0,2,0,0,0,0|2,0,0]=4 6623 B12R1.1703 NNC(=O)c1ccc(cc1Cl)Cl 1P003G7Q [0,2,0,0,0,0|2,0,0]=4 6624 B12R1.1703 NNC(=O)c1ccc(cc1Cl)F 1P00A6IC [0,2,0,0,0,0|2,0,0]=4 6625 B12R1.1703 NNC(=O)c1ccc(cc1F)Cl 1P009MF8 [0,2,0,0,0,0|2,0,0]=4 6626 B12R1.1703 NNC(=O)c1ccc(cc1F)F 1P00HF6N [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.1703 NNC(=O)c1ccc(cc1O)C 1P019W8I [0,2,0,0,0,0|1,0,0]=3 6628 B12R1.1703 NNC(=O)c1ccc(cc1O)Cl 1P00FDNM [0,2,0,0,0,0|1,0,0]=3 6629 B12R1.1703 NNC(=O)c1ccc(cc1O)I 1P00440O [0,2,0,0,0,0|1,0,0]=3 6630 B12R1.1703 NNC(=O)c1ccc(cc1O)N 1P006DQH [0,2,0,0,0,0|1,0,0]=3 6631 B12R1.1703 NNC(=O)c1ccc(cc1O)O 1P0010UK [0,2,0,0,0,0|1,0,0]=3 6632 B12R1.1703 OCC(=C)c1ccc(cc1F)F 1P001GEN [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.1703 OCC(=O)c1ccc(cc1Cl)Cl 1P001876 [0,2,0,0,0,0|1,0,0]=3 6634 B12R1.1703 OCC(=O)c1ccc(cc1F)F 1P001L6D [0,2,0,0,0,0|1,0,0]=3 6635 B12R1.1703 OC[C@@H](c1ccc(cc1O)F)N 1P01DUOY [0,2,0,0,0,0|1,0,1]=4 6636 B12R1.1703 ON=C(c1ccc(cc1Br)Cl)Cl 1P0291X2 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.1703 ON=C(c1ccc(cc1C)O)N 1P0289JV [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.1703 ON=C(c1ccc(cc1Cl)Cl)Cl 1P002Y4P [0,2,0,0,0,0|2,0,0]=4 6639 B12R1.1703 ON=C(c1ccc(cc1Cl)F)N 1P01AIYY [0,2,0,0,0,0|2,0,0]=4 6640 B12R1.1703 ON=C(c1ccc(cc1Cl)O)N 1P01AJ2V [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.1703 ON=C(c1ccc(cc1F)Br)C 1P01BAZI [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.1703 ONC(=N)c1ccc(cc1F)O 1P008DBZ [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.1703 ONC(=O)c1ccc(cc1O)C 1P00AON9 [0,2,0,0,0,0|0,0,0]=2 6644 B12R1.1703 ONC(=O)c1ccc(cc1O)Cl 1P00EAC8 [0,2,0,0,0,0|0,0,0]=2 6645 B12R1.1703 ONC(=O)c1ccc(cc1O)N 1P0288S9 [0,2,0,0,0,0|0,0,0]=2 6646 B12R1.1703 O\N=C(\c1ccc(cc1Br)F)/C 1P0284VH [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.1703 O\N=C(\c1ccc(cc1Cl)Cl)/N 1P003G80 [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.1703 O\N=C(\c1ccc(cc1F)C)/N 1P0290QX [0,2,0,0,0,0|2,0,0]=4 6649 B12R1.1703 O\N=C(\c1ccc(cc1F)F)/N 1P003G96 [0,2,0,0,0,0|2,0,0]=4 6650 B12R1.354 BrCC(=O)c1cc(Br)ccc1Cl 1P000SHA [0,2,0,0,0,0|2,0,0]=4 6651 B12R1.354 BrCC(=O)c1cc(Br)ccc1F 1P009Z8M [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.354 BrCC(=O)c1cc(Br)ccc1O 1P003GCH [0,2,0,0,0,0|1,0,0]=3 6653 B12R1.354 CCC(=O)c1cc(Br)ccc1F 1P004N6D [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.354 CCC(=O)c1cc(Br)ccc1N 1P01BKXS [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.354 CCC(=O)c1cc(Br)ccc1O 1P0025W7 [0,2,0,0,0,0|1,0,0]=3 6656 B12R1.354 CCC(=O)c1cc(C)ccc1C 1P00C8M7 [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.354 CCC(=O)c1cc(C)ccc1O 1P003GQS [0,2,0,0,0,0|1,0,0]=3 6658 B12R1.354 CCC(=O)c1cc(Cl)ccc1Cl 1P003WKN [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.354 CCC(=O)c1cc(Cl)ccc1O 1P002XK1 [0,2,0,0,0,0|1,0,0]=3 6660 B12R1.354 CCC(=O)c1cc(F)ccc1F 1P002XU1 [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.354 CCC(=O)c1cc(F)ccc1O 1P003MS6 [0,2,0,0,0,0|1,0,0]=3 6662 B12R1.354 CCC(=O)c1cc(N)ccc1F 1P01DZGN [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.354 CNC(=O)c1cc(Br)ccc1Cl 1P003SDX [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.354 CNC(=O)c1cc(Br)ccc1F 1P00HA04 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.354 CNC(=O)c1cc(Br)ccc1N 1P01A1O3 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.354 CNC(=O)c1cc(C)ccc1N 1P01AKY7 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.354 CNC(=O)c1cc(Cl)ccc1N 1P007556 [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.354 CNC(=O)c1cc(F)ccc1F 1P00I87L [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.354 CNC(=O)c1cc(N)ccc1Cl 1P0082YV [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.354 CNC(=O)c1cc(N)ccc1Cl 1P019W9O [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.354 CNC(=O)c1cc(N)ccc1F 1P008VO9 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.354 CNC(=O)c1cc(N)ccc1F 1P00J2VU [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.354 CNC(=O)c1cc(O)ccc1N 1P02821X [0,2,0,0,0,0|2,0,0]=4 6674 B12R1.354 COC(=O)c1c(Br)ccc(=O)[nH]1 1P0015C7 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.354 COC(=O)c1c(Cl)ccc(=O)[nH]1 1P0015CB [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.354 COC(=O)c1cc(Br)c[nH]c1=O 1P000QLX [0,2,0,0,0,0|1,0,1]=4 6677 B12R1.354 COC(=O)c1cc(Br)ccc1Br 1P0037ML [0,2,0,0,0,0|1,0,0]=3 6678 B12R1.354 COC(=O)c1cc(Br)ccc1Cl 1P002QYD [0,2,0,0,0,0|1,0,0]=3 6679 B12R1.354 COC(=O)c1cc(Br)ccc1F 1P0037ZN [0,2,0,0,0,0|1,0,0]=3 6680 B12R1.354 COC(=O)c1cc(Br)ccc1I 1P0023K9 [0,2,0,0,0,0|1,0,0]=3 6681 B12R1.354 COC(=O)c1cc(Br)ccc1N 1P00DE8N [0,2,0,0,0,0|1,0,0]=3 6682 B12R1.354 COC(=O)c1cc(Br)ccc1O 1P003SE6 [0,2,0,0,0,0|0,0,0]=2 6683 B12R1.354 COC(=O)c1cc(Br)ccc1S 1P01DLW3 [0,2,0,0,0,0|0,1,0]=3 6684 B12R1.354 COC(=O)c1cc(Br)cnc1Br 1P00G8Z0 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.354 COC(=O)c1cc(Br)cnc1Cl 1P003SDY [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.354 COC(=O)c1cc(Br)cnc1F 1P00GWEJ [0,2,0,0,0,0|2,0,0]=4 6687 B12R1.354 COC(=O)c1cc(Br)cnc1N 1P003S3K [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.354 COC(=O)c1cc(Br)ncc1Br 1P0015EK [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.354 COC(=O)c1cc(Br)ncc1Cl 1P0015AM [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.354 COC(=O)c1cc(Br)ncc1F 1P00GURY [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.354 COC(=O)c1cc(Br)ncc1N 1P001283 [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.354 COC(=O)c1cc(Br)ncc1O 1P000OVE [0,2,0,0,0,0|1,0,0]=3 6693 B12R1.354 COC(=O)c1cc(C)ccc1Br 1P00IGU7 [0,2,0,0,0,0|1,0,0]=3 6694 B12R1.354 COC(=O)c1cc(C)ccc1C 1P0013JF [0,2,0,0,0,0|1,0,0]=3 6695 B12R1.354 COC(=O)c1cc(C)ccc1Cl 1P001TCC [0,2,0,0,0,0|1,0,0]=3 6696 B12R1.354 COC(=O)c1cc(C)ccc1F 1P002ZI7 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.354 COC(=O)c1cc(C)ccc1I 1P007H5I [0,2,0,0,0,0|1,0,0]=3 6698 B12R1.354 COC(=O)c1cc(C)ccc1N 1P003S3N [0,2,0,0,0,0|1,0,0]=3 6699 B12R1.354 COC(=O)c1cc(C)ccc1N 1P01AH8V [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.354 COC(=O)c1cc(C)ccc1O 1P003S4T [0,2,0,0,0,0|0,0,0]=2 6701 B12R1.354 COC(=O)c1cc(C)cnc1Br 1P007N5G [0,2,0,0,0,0|2,0,0]=4 6702 B12R1.354 COC(=O)c1cc(C)cnc1Cl 1P00EAGI [0,2,0,0,0,0|2,0,0]=4 6703 B12R1.354 COC(=O)c1cc(C)cnc1F 1P01DO3V [0,2,0,0,0,0|2,0,0]=4 6704 B12R1.354 COC(=O)c1cc(C)cnc1N 1P004ADP [0,2,0,0,0,0|2,0,0]=4 6705 B12R1.354 COC(=O)c1cc(C)ncc1N 1P01XDRS [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.354 COC(=O)c1cc(Cl)c[nH]c1=O 1P00GU26 [0,2,0,0,0,0|1,0,1]=4 6707 B12R1.354 COC(=O)c1cc(Cl)ccc1Br 1P00BG1X [0,2,0,0,0,0|1,0,0]=3 6708 B12R1.354 COC(=O)c1cc(Cl)ccc1F 1P00F1KD [0,2,0,0,0,0|1,0,0]=3 6709 B12R1.354 COC(=O)c1cc(Cl)ccc1I 1P002XHM [0,2,0,0,0,0|1,0,0]=3 6710 B12R1.354 COC(=O)c1cc(Cl)ccc1N 1P0035OO [0,2,0,0,0,0|1,0,0]=3 6711 B12R1.354 COC(=O)c1cc(Cl)ccc1O 1P003SE8 [0,2,0,0,0,0|0,0,0]=2 6712 B12R1.354 COC(=O)c1cc(Cl)ccc1S 1P0292H6 [0,2,0,0,0,0|0,1,0]=3 6713 B12R1.354 COC(=O)c1cc(Cl)cnc1Br 1P00158N [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.354 COC(=O)c1cc(Cl)cnc1Cl 1P006KBK [0,2,0,0,0,0|2,0,0]=4 6715 B12R1.354 COC(=O)c1cc(Cl)cnc1N 1P006WMQ [0,2,0,0,0,0|2,0,0]=4 6716 B12R1.354 COC(=O)c1cc(Cl)ncc1Br 1P0036R8 [0,2,0,0,0,0|2,0,0]=4 6717 B12R1.354 COC(=O)c1cc(Cl)ncc1Cl 1P00ECWY [0,2,0,0,0,0|2,0,0]=4 6718 B12R1.354 COC(=O)c1cc(Cl)ncc1F 1P004HDY [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.354 COC(=O)c1cc(Cl)ncc1N 1P007WYM [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.354 COC(=O)c1cc(Cl)ncc1O 1P000OUA [0,2,0,0,0,0|1,0,0]=3 6721 B12R1.354 COC(=O)c1cc(F)ccc1Br 1P003H6A [0,2,0,0,0,0|1,0,0]=3 6722 B12R1.354 COC(=O)c1cc(F)ccc1F 1P007AP0 [0,2,0,0,0,0|1,0,0]=3 6723 B12R1.354 COC(=O)c1cc(F)ccc1I 1P0094H7 [0,2,0,0,0,0|1,0,0]=3 6724 B12R1.354 COC(=O)c1cc(F)ccc1N 1P00I6ID [0,2,0,0,0,0|1,0,0]=3 6725 B12R1.354 COC(=O)c1cc(F)ccc1O 1P003SEF [0,2,0,0,0,0|0,0,0]=2 6726 B12R1.354 COC(=O)c1cc(F)ccc1S 1P028R6J [0,2,0,0,0,0|0,1,0]=3 6727 B12R1.354 COC(=O)c1cc(F)cnc1Br 1P009EW6 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.354 COC(=O)c1cc(F)cnc1Cl 1P004YA1 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.354 COC(=O)c1cc(F)cnc1F 1P0015DM [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.354 COC(=O)c1cc(F)cnc1N 1P009X56 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.354 COC(=O)c1cc(I)c[nH]c1=O 1P000CTG [0,2,0,0,0,0|1,0,1]=4 6732 B12R1.354 COC(=O)c1cc(I)ccc1Br 1P00FFUZ [0,2,0,0,0,0|1,0,0]=3 6733 B12R1.354 COC(=O)c1cc(I)ccc1Cl 1P00IBFJ [0,2,0,0,0,0|1,0,0]=3 6734 B12R1.354 COC(=O)c1cc(I)ccc1F 1P003HQV [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.354 COC(=O)c1cc(I)ccc1I 1P01FFYX [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.354 COC(=O)c1cc(I)ccc1N 1P003S3M [0,2,0,0,0,0|1,0,0]=3 6737 B12R1.354 COC(=O)c1cc(I)ccc1O 1P003SEM [0,2,0,0,0,0|0,0,0]=2 6738 B12R1.354 COC(=O)c1cc(I)cnc1Cl 1P0036X9 [0,2,0,0,0,0|2,0,0]=4 6739 B12R1.354 COC(=O)c1cc(I)cnc1N 1P000JHE [0,2,0,0,0,0|2,0,0]=4 6740 B12R1.354 COC(=O)c1cc(N)ccc1Br 1P00379H [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.354 COC(=O)c1cc(N)ccc1Br 1P01AGKW [0,2,0,0,0,0|1,0,0]=3 6742 B12R1.354 COC(=O)c1cc(N)ccc1Cl 1P00743P [0,2,0,0,0,0|1,0,0]=3 6743 B12R1.354 COC(=O)c1cc(N)ccc1Cl 1P00BL8Y [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.354 COC(=O)c1cc(N)ccc1F 1P00BLID [0,2,0,0,0,0|1,0,0]=3 6745 B12R1.354 COC(=O)c1cc(N)ccc1F 1P00EA7A [0,2,0,0,0,0|1,0,0]=3 6746 B12R1.354 COC(=O)c1cc(N)ccc1I 1P00944K [0,2,0,0,0,0|1,0,0]=3 6747 B12R1.354 COC(=O)c1cc(N)ccc1N 1P00708D [0,2,0,0,0,0|1,0,0]=3 6748 B12R1.354 COC(=O)c1cc(N)ccc1O 1P003SDN [0,2,0,0,0,0|0,0,0]=2 6749 B12R1.354 COC(=O)c1cc(N)cnc1Br 1P028YVC [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.354 COC(=O)c1cc(N)cnc1Cl 1P00IFQX [0,2,0,0,0,0|2,0,0]=4 6751 B12R1.354 COC(=O)c1cc(N)cnc1O 1P028MHN [0,2,0,0,0,0|1,0,0]=3 6752 B12R1.354 COC(=O)c1cc(N)ncc1Br 1P004DAK [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.354 COC(=O)c1cc(N)ncc1Cl 1P000JHG [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.354 COC(=O)c1cc(N)ncc1F 1P00HVOJ [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.354 COC(=O)c1cc(O)ccc1Br 1P00AC9F [0,2,0,0,0,0|1,0,0]=3 6756 B12R1.354 COC(=O)c1cc(O)ccc1Cl 1P002PL4 [0,2,0,0,0,0|1,0,0]=3 6757 B12R1.354 COC(=O)c1cc(O)ccc1F 1P007V7U [0,2,0,0,0,0|1,0,0]=3 6758 B12R1.354 COC(=O)c1cc(O)ccc1N 1P002H8B [0,2,0,0,0,0|1,0,0]=3 6759 B12R1.354 COC(=O)c1cc(O)ccc1O 1P0035MA [0,2,0,0,0,0|0,0,0]=2 6760 B12R1.354 COC(=O)c1cc(O)cnc1Cl 1P000OX4 [0,2,0,0,0,0|2,0,0]=4 6761 B12R1.354 COC(=O)c1cc(O)ncc1Br 1P00GTTF [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.354 COC(=O)c1cc(S)ccc1Br 1P02918S [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.354 COC(=O)c1cc(S)ccc1Cl 1P019U9M [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.354 COC(=O)c1nc(Br)ccc1Cl 1P00I7EL [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.354 COC(=O)c1nc(Br)ccc1F 1P00159X [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.354 COC(=O)c1nc(Br)ccc1N 1P0036TV [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.354 COC(=O)c1nc(Br)ccc1O 1P00CJ9I [0,2,0,0,0,0|1,0,0]=3 6768 B12R1.354 COC(=O)c1nc(C)ccc1Br 1P01DZ2O [0,2,0,0,0,0|2,0,0]=4 6769 B12R1.354 COC(=O)c1nc(C)ccc1F 1P009EVO [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.354 COC(=O)c1nc(C)ccc1N 1P021T2F [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.354 COC(=O)c1nc(C)ccc1O 1P00EKBF [0,2,0,0,0,0|1,0,0]=3 6772 B12R1.354 COC(=O)c1nc(Cl)ccc1Br 1P00159A [0,2,0,0,0,0|2,0,0]=4 6773 B12R1.354 COC(=O)c1nc(Cl)ccc1Cl 1P0039E4 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.354 COC(=O)c1nc(Cl)ccc1F 1P01K74M [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.354 COC(=O)c1nc(Cl)ccc1N 1P008FQI [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.354 COC(=O)c1nc(F)ccc1Br 1P00HGLC [0,2,0,0,0,0|2,0,0]=4 6777 B12R1.354 COC(=O)c1nc(N)ccc1Br 1P0026WQ [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.354 COC(=O)c1nc(N)ccc1Cl 1P000OY6 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.354 Cc1cc(C(=O)NN)c(cc1)Br 1P027W7K [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.354 Cc1cc(C(=O)NN)c(cc1)N 1P002VUA [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.354 Cc1cc(C(=O)NO)c(cc1)O 1P00EAT5 [0,2,0,0,0,0|0,0,0]=2 6782 B12R1.354 Cc1ccc(cc1C(=O)CBr)C 1P008POG [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.354 Cc1ccc(cc1C(=O)CBr)Cl 1P028GZ3 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.354 Cc1ccc(cc1C(=O)CBr)F 1P028ZYU [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.354 Cc1ccc(cc1C(=O)CC)Cl 1P000J4K [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.354 Cc1ccc(cc1C(=O)CCl)C 1P00DD7B [0,2,0,0,0,0|2,0,0]=4 6787 B12R1.354 Cc1ccc(cc1C(=O)CO)C 1P01B9Q9 [0,2,0,0,0,0|1,0,0]=3 6788 B12R1.354 Cc1ccc(cc1C(=O)NC)Br 1P01BBNO [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.354 Cc1ccc(cc1C(=O)NN)Br 1P00HFHF [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.354 Cc1ccc(cc1C(=O)NN)F 1P02937W [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.354 Cc1ccc(cc1C(=O)OC)Br 1P003SE1 [0,2,0,0,0,0|1,0,0]=3 6792 B12R1.354 Cc1ccc(cc1C(=O)OC)Cl 1P003N44 [0,2,0,0,0,0|1,0,0]=3 6793 B12R1.354 Cc1ccc(cc1C(=O)OC)F 1P0021B4 [0,2,0,0,0,0|1,0,0]=3 6794 B12R1.354 Cc1ccc(cc1C(=O)OC)I 1P008UGW [0,2,0,0,0,0|1,0,0]=3 6795 B12R1.354 Cc1ccc(cc1C(=O)OC)N 1P003SDO [0,2,0,0,0,0|1,0,0]=3 6796 B12R1.354 Cc1ccc(cc1C(=O)OC)O 1P005ZPK [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.354 Cc1ccc(nc1C(=O)OC)Br 1P001COO [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.354 Cc1ccc(nc1C(=O)OC)Cl 1P004F59 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.354 Cc1ccc(nc1C(=O)OC)N 1P01BA6P [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.354 Cc1cnc(cc1C(=O)OC)Cl 1P00G8QJ [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.354 Cc1cnc(cc1C(=O)OC)F 1P020KW3 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.354 Cc1cnc(cc1C(=O)OC)N 1P01ANPL [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.354 Cc1ncc(cc1C(=O)OC)Br 1P0015TL [0,2,0,0,0,0|2,0,0]=4 6804 B12R1.354 Cc1ncc(cc1C(=O)OC)Cl 1P007GUI [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.354 Cc1ncc(cc1C(=O)OC)F 1P01KL88 [0,2,0,0,0,0|2,0,0]=4 6806 B12R1.354 Cc1ncc(cc1C(=O)OC)N 1P0062E4 [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.354 ClCC(=O)c1cc(Cl)ccc1Cl 1P008Q1F [0,2,0,0,0,0|2,0,0]=4 6808 B12R1.354 Clc1ccc(cc1C(=O)C#N)Cl 1P01BKWK [0,2,0,0,0,0|2,0,0]=4 6809 B12R1.354 Clc1ccc(cc1C(=O)CBr)Cl 1P00DEAL [0,2,0,0,0,0|2,0,0]=4 6810 B12R1.354 Fc1ccc(cc1C(=O)CBr)F 1P007O17 [0,2,0,0,0,0|2,0,0]=4 6811 B12R1.354 Fc1ccc(cc1C(=O)CCl)F 1P00E949 [0,2,0,0,0,0|2,0,0]=4 6812 B12R1.354 NCC(=O)c1cc(Cl)ccc1F 1P01C0NA [0,2,0,0,0,0|2,0,0]=4 6813 B12R1.354 NNC(=O)c1cc(Br)ccc1O 1P0078K1 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.354 NNC(=O)c1cc(Cl)ccc1Cl 1P003GDY [0,2,0,0,0,0|2,0,0]=4 6815 B12R1.354 NNC(=O)c1cc(Cl)ccc1F 1P00FLVS [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.354 NNC(=O)c1cc(Cl)ccc1O 1P00D9EN [0,2,0,0,0,0|1,0,0]=3 6817 B12R1.354 NNC(=O)c1cc(F)ccc1Br 1P01AB2S [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.354 NNC(=O)c1cc(F)ccc1F 1P002U6F [0,2,0,0,0,0|2,0,0]=4 6819 B12R1.354 NNC(=O)c1cc(I)ccc1O 1P0293VG [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.354 NNC(=O)c1cc(N)ccc1C 1P027VGO [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.354 NNC(=O)c1cc(N)ccc1F 1P027VZJ [0,2,0,0,0,0|2,0,0]=4 6822 B12R1.354 NNC(=O)c1cc(N)ccc1O 1P01GGFR [0,2,0,0,0,0|1,0,0]=3 6823 B12R1.354 NNC(=O)c1cc(O)ccc1O 1P001Q9W [0,2,0,0,0,0|1,0,0]=3 6824 B12R1.354 Nc1ccc(cc1C(=O)NN)Cl 1P00DCNC [0,2,0,0,0,0|2,0,0]=4 6825 B12R1.354 Nc1ccc(cc1C(=O)NN)F 1P0198T4 [0,2,0,0,0,0|2,0,0]=4 6826 B12R1.354 ONC(=O)c1nc(Br)ccc1F 1P01DWIS [0,2,0,0,0,0|2,0,0]=4 6827 B12R1.354 Oc1ccc(cc1C(=O)CBr)Cl 1P003H5Y [0,2,0,0,0,0|1,0,0]=3 6828 B12R1.354 Oc1ccc(cc1C(=O)CBr)F 1P000TFL [0,2,0,0,0,0|1,0,0]=3 6829 B12R1.354 Oc1ccc(cc1C(=O)CBr)O 1P002QN3 [0,2,0,0,0,0|1,0,0]=3 6830 B12R1.354 Oc1ccc(cc1C(=O)CCl)F 1P00C3LN [0,2,0,0,0,0|1,0,0]=3 6831 B12R1.354 Oc1ccc(cc1C(=O)CCl)O 1P00ED0M [0,2,0,0,0,0|1,0,0]=3 6832 B12R1.354 Oc1ccc(cc1C(=O)NO)Cl 1P00CJ53 [0,2,0,0,0,0|0,0,0]=2 6833 B12R1.453 BrCc1ccc(c(c1)C(=O)O)Br 1P00I5EM [0,2,0,0,0,0|1,0,0]=3 6834 B12R1.453 BrCc1ccc(c(c1)C(=O)O)F 1P00556V [0,2,0,0,0,0|1,0,0]=3 6835 B12R1.453 C#Cc1ccc(c(c1)C(=O)C)Cl 1P028XD4 [0,2,0,0,0,0|2,0,0]=4 6836 B12R1.453 C#Cc1ccc(c(c1)C(=O)O)Br 1P0291VT [0,2,0,0,0,0|1,0,0]=3 6837 B12R1.453 C#Cc1ccc(c(c1)C(=O)O)Cl 1P01T2MU [0,2,0,0,0,0|1,0,0]=3 6838 B12R1.453 C#Cc1ccc(c(c1)C(=O)O)F 1P020HSO [0,2,0,0,0,0|1,0,0]=3 6839 B12R1.453 C#Cc1ccc(c(n1)C(=O)O)Cl 1P027PDA [0,2,0,0,0,0|2,0,0]=4 6840 B12R1.453 CCc1c[nH]c(=O)c(c1)C(=O)O 1P01E9I6 [0,2,0,0,0,0|1,0,1]=4 6841 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1P002OXC [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.453 CCc1ccc(c(c1)C(=O)O)Br 1P0096Z8 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.453 CCc1ccc(c(c1)C(=O)O)C 1P028QTY [0,2,0,0,0,0|1,0,0]=3 6844 B12R1.453 CCc1ccc(c(c1)C(=O)O)Cl 1P01EXC9 [0,2,0,0,0,0|1,0,0]=3 6845 B12R1.453 CCc1ccc(c(c1)C(=O)O)F 1P01E6MA [0,2,0,0,0,0|1,0,0]=3 6846 B12R1.453 CCc1ccc(c(c1)C(=O)O)N 1P002PS6 [0,2,0,0,0,0|1,0,0]=3 6847 B12R1.453 CCc1ccc(c(c1)C(=O)O)O 1P003N6P [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.453 CCc1ccc(c(c1)[N+](=O)[O-])O 1P00EK7U [0,2,0,0,0,0|1,0,1]=4 6849 B12R1.453 CNc1ccc(c(c1)C(=O)O)Cl 1P01BCBY [0,2,0,0,0,0|1,0,0]=3 6850 B12R1.453 CNc1ccc(c(n1)C(=O)O)Br 1P028CBM [0,2,0,0,0,0|2,0,0]=4 6851 B12R1.453 CNc1ncc(c(c1)C(=O)O)Br 1P028WRC [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.453 COc1cc[n+](c(c1)C(=O)O)[O-] 1P007DOA [0,2,0,0,0,0|1,0,1]=4 6853 B12R1.453 COc1ccc(c(c1)C(=O)C)Br 1P00ED51 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 1P005O5Y [0,2,0,0,0,0|2,0,0]=4 6855 B12R1.453 COc1ccc(c(c1)C(=O)C)F 1P00G9TK [0,2,0,0,0,0|2,0,0]=4 6856 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1P0033T5 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.453 COc1ccc(c(c1)C(=O)N)Br 1P00IKT3 [0,2,0,0,0,0|2,0,0]=4 6858 B12R1.453 COc1ccc(c(c1)C(=O)N)F 1P00CLT2 [0,2,0,0,0,0|2,0,0]=4 6859 B12R1.453 COc1ccc(c(c1)C(=O)N)N 1P002H8C [0,2,0,0,0,0|2,0,0]=4 6860 B12R1.453 COc1ccc(c(c1)C(=O)N)O 1P002W49 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.453 COc1ccc(c(c1)C(=O)O)Br 1P002LZ4 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.453 COc1ccc(c(c1)C(=O)O)C 1P003NAO [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.453 COc1ccc(c(c1)C(=O)O)Cl 1P003HFR [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.453 COc1ccc(c(c1)C(=O)O)F 1P0078QK [0,2,0,0,0,0|1,0,0]=3 6865 B12R1.453 COc1ccc(c(c1)C(=O)O)I 1P00DIB9 [0,2,0,0,0,0|1,0,0]=3 6866 B12R1.453 COc1ccc(c(c1)C(=O)O)N 1P002H8D [0,2,0,0,0,0|1,0,0]=3 6867 B12R1.453 COc1ccc(c(c1)C(=O)O)N 1P003A33 [0,2,0,0,0,0|1,0,0]=3 6868 B12R1.453 COc1ccc(c(c1)C(=O)O)O 1P002S81 [0,2,0,0,0,0|0,0,0]=2 6869 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])O 1P001PHL [0,2,0,0,0,0|1,0,1]=4 6870 B12R1.453 COc1ccc(c(n1)C(=O)O)Br 1P000PRA [0,2,0,0,0,0|2,0,0]=4 6871 B12R1.453 COc1ccc(c(n1)C(=O)O)C 1P01KM41 [0,2,0,0,0,0|2,0,0]=4 6872 B12R1.453 COc1ccc(c(n1)C(=O)O)Cl 1P0050YO [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.453 COc1ccc(c(n1)C(=O)O)F 1P00159D [0,2,0,0,0,0|2,0,0]=4 6874 B12R1.453 COc1ccc(c(n1)C(=O)O)N 1P008G27 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.453 COc1cnc(c(c1)C(=O)O)C 1P01JVED [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.453 COc1cnc(c(c1)C(=O)O)Cl 1P005AUU [0,2,0,0,0,0|2,0,0]=4 6877 B12R1.453 COc1cnc(c(c1)C(=O)O)F 1P0015SR [0,2,0,0,0,0|2,0,0]=4 6878 B12R1.453 COc1ncc(c(c1)C(=O)O)Br 1P004AVL [0,2,0,0,0,0|2,0,0]=4 6879 B12R1.453 COc1ncc(c(c1)C(=O)O)Cl 1P008AMF [0,2,0,0,0,0|2,0,0]=4 6880 B12R1.453 COc1ncc(c(c1)C(=O)O)F 1P004F2S [0,2,0,0,0,0|2,0,0]=4 6881 B12R1.453 COc1ncc(c(c1)C(=O)O)N 1P003MU1 [0,2,0,0,0,0|2,0,0]=4 6882 B12R1.453 CSc1ccc(c(c1)C(=O)N)Cl 1P019VXN [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.453 CSc1ccc(c(c1)C(=O)O)C 1P002SWW [0,2,0,0,0,0|1,0,0]=3 6884 B12R1.453 CSc1ccc(c(c1)C(=O)O)Cl 1P003HEQ [0,2,0,0,0,0|1,0,0]=3 6885 B12R1.453 CSc1ccc(c(c1)C(=O)O)F 1P00EH15 [0,2,0,0,0,0|1,0,0]=3 6886 B12R1.453 CSc1ccc(c(c1)C(=O)O)O 1P007H9N [0,2,0,0,0,0|0,0,0]=2 6887 B12R1.453 CSc1ccc(c(n1)C(=O)O)Cl 1P028ESD [0,2,0,0,0,0|2,0,0]=4 6888 B12R1.453 ClCc1ccc(c(c1)[N+](=O)[O-])O 1P006NUK [0,2,0,0,0,0|1,0,1]=4 6889 B12R1.453 N#Cc1ccc(c(c1)B(O)O)O 1P000OKQ [0,2,0,0,0,0|1,0,1]=4 6890 B12R1.453 N#Cc1ccc(c(c1)C(=O)C)Br 1P01NLM7 [0,2,0,0,0,0|2,0,0]=4 6891 B12R1.453 N#Cc1ccc(c(c1)C(=O)C)F 1P00BG5T [0,2,0,0,0,0|2,0,0]=4 6892 B12R1.453 N#Cc1ccc(c(c1)C(=O)C)O 1P003JA0 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.453 N#Cc1ccc(c(c1)C(=O)Cl)Cl 1P00A6RS [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)Br 1P00533N [0,2,0,0,0,0|1,0,0]=3 6895 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)C 1P002BB5 [0,2,0,0,0,0|1,0,0]=3 6896 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)Cl 1P00H1EV [0,2,0,0,0,0|1,0,0]=3 6897 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)F 1P001ECN [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)I 1P00BJ1Q [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)N 1P0036Q7 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.453 N#Cc1ccc(c(c1)C(=O)O)O 1P008YF7 [0,2,0,0,0,0|0,0,0]=2 6901 B12R1.453 N#Cc1ccc(c(c1)[N+](=O)[O-])O 1P00I6PI [0,2,0,0,0,0|1,0,1]=4 6902 B12R1.453 N#Cc1cnc(c(c1)C(=O)O)F 1P027W9I [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.453 NCc1ccc(c(c1)C(=O)O)Cl 1P01DEDI [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.453 NCc1ccc(c(c1)C(=O)O)F 1P028TQB [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.453 NCc1ccc(c(c1)[N+](=O)[O-])O 1P01EI8T [0,2,0,0,0,0|1,0,1]=4 6906 B12R1.453 NNc1ccc(c(c1)C(=O)O)Br 1P0288HQ [0,2,0,0,0,0|1,0,0]=3 6907 B12R1.453 NNc1ccc(c(c1)C(=O)O)Cl 1P019HYU [0,2,0,0,0,0|1,0,0]=3 6908 B12R1.453 NNc1ccc(c(c1)C(=O)O)F 1P01C1L7 [0,2,0,0,0,0|1,0,0]=3 6909 B12R1.453 O=Cc1ccc(c(c1)C(=O)N)F 1P01XGGT [0,2,0,0,0,0|2,0,0]=4 6910 B12R1.453 O=Cc1ccc(c(c1)C(=O)N)O 1P00GABY [0,2,0,0,0,0|1,0,0]=3 6911 B12R1.453 O=Cc1ccc(c(c1)C(=O)O)Br 1P01FHPE [0,2,0,0,0,0|1,0,0]=3 6912 B12R1.453 O=Cc1ccc(c(c1)C(=O)O)C 1P00HB54 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.453 O=Cc1ccc(c(c1)C(=O)O)F 1P00382P [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.453 O=Cc1ccc(c(c1)C(=O)O)O 1P003N8O [0,2,0,0,0,0|0,0,0]=2 6915 B12R1.453 O=Cc1ccc(c(c1)[N+](=O)[O-])O 1P003LYT [0,2,0,0,0,0|1,0,1]=4 6916 B12R1.453 OCc1ccc(c(c1)C(=O)O)Br 1P01JMQT [0,2,0,0,0,0|1,0,0]=3 6917 B12R1.453 OCc1ccc(c(c1)C(=O)O)Cl 1P006U61 [0,2,0,0,0,0|1,0,0]=3 6918 B12R1.453 OCc1ccc(c(c1)C(=O)O)F 1P006YEG [0,2,0,0,0,0|1,0,0]=3 6919 B12R1.453 OCc1ccc(c(c1)C(=O)O)O 1P003HVB [0,2,0,0,0,0|0,0,0]=2 6920 B12R1.453 OCc1ccc(c(c1)[N+](=O)[O-])O 1P00C8RO [0,2,0,0,0,0|1,0,1]=4 6921 B12R1.308 C=CCC(=O)c1ccccc1F 1P01A2FB [0,2,0,0,0,0|2,0,0]=4 6922 B12R1.308 C=COC(=O)c1ccccc1Cl 1P001PRS [0,2,0,0,0,0|1,0,0]=3 6923 B12R1.308 CCCC(=O)c1ccccc1Cl 1P01DWP9 [0,2,0,0,0,0|2,0,0]=4 6924 B12R1.308 CCCC(=O)c1ccccc1O 1P002XD6 [0,2,0,0,0,0|1,0,0]=3 6925 B12R1.308 CCNC(=O)c1ccccc1Br 1P005E2H [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.308 CCNC(=O)c1ccccc1N 1P00CHT6 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.308 CCNC(=O)c1ccccc1O 1P00DDNV [0,2,0,0,0,0|1,0,0]=3 6928 B12R1.308 CCOC(=N)c1ccccc1Cl 1P028G0J [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.308 CCOC(=O)c1ccc[nH]c1=O 1P002V97 [0,2,0,0,0,0|1,0,1]=4 6930 B12R1.308 CCOC(=O)c1ccccc1Br 1P003QKA [0,2,0,0,0,0|1,0,0]=3 6931 B12R1.308 CCOC(=O)c1ccccc1C 1P0035BA [0,2,0,0,0,0|1,0,0]=3 6932 B12R1.308 CCOC(=O)c1ccccc1Cl 1P003QKF [0,2,0,0,0,0|1,0,0]=3 6933 B12R1.308 CCOC(=O)c1ccccc1F 1P003HS7 [0,2,0,0,0,0|1,0,0]=3 6934 B12R1.308 CCOC(=O)c1ccccc1I 1P0024OX [0,2,0,0,0,0|1,0,0]=3 6935 B12R1.308 CCOC(=O)c1ccccc1O 1P0033TD [0,2,0,0,0,0|0,0,0]=2 6936 B12R1.308 CCOC(=O)c1cccnc1Br 1P00DC70 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.308 CCOC(=O)c1cccnc1Cl 1P0035B7 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.308 CCOC(=O)c1cccnc1F 1P000AHN [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.308 CCOC(=O)c1cccnc1N 1P003QK3 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.308 CCOC(=O)c1cccnc1S 1P019MY2 [0,2,0,0,0,0|1,1,0]=4 6941 B12R1.308 CCOC(=O)c1ccncc1Br 1P001BSJ [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.308 CCOC(=O)c1ccncc1Cl 1P00C4NJ [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.308 CCOC(=O)c1ccncc1N 1P001I6S [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.308 CCOC(=O)c1ccncc1O 1P00280S [0,2,0,0,0,0|1,0,0]=3 6945 B12R1.308 CCOC(=O)c1cnccc1Cl 1P00205S [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.308 CCOC(=O)c1cnccc1N 1P00AQA3 [0,2,0,0,0,0|2,0,0]=4 6947 B12R1.308 CCOC(=O)c1cncnc1O 1P00FH3N [0,2,0,0,0,0|2,0,0]=4 6948 B12R1.308 CCOC(=O)c1ncccc1Br 1P00I8SC [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.308 CCOC(=O)c1ncccc1C 1P003QOV [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.308 CCOC(=O)c1ncccc1Cl 1P009DDO [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.308 CCOC(=O)c1ncccc1F 1P008UF6 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.308 CCOC(=O)c1ncccc1N 1P002UFI [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.308 CCOC(=O)c1ncccc1O 1P00FEVV [0,2,0,0,0,0|1,0,0]=3 6954 B12R1.308 CNCC(=O)c1ccccc1Cl 1P01BILJ [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.308 COCC(=O)c1ccccc1Cl 1P028NT2 [0,2,0,0,0,0|1,0,0]=3 6956 B12R1.308 COCC(=O)c1ccccc1F 1P0285IF [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.308 CON=C(c1ccccc1F)C 1P01ALNM [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.308 CONC(=O)c1ccccc1N 1P01DUJU [0,2,0,0,0,0|1,0,0]=3 6959 B12R1.308 Cc1ccncc1C(=O)OCC 1P00DIJF [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.308 Cc1ncccc1C(=O)OCC 1P003QLI [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.308 ClCCC(=O)c1ccccc1F 1P00GTV0 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.308 ClCCC(=O)c1ccccc1O 1P00I7LN [0,2,0,0,0,0|1,0,0]=3 6963 B12R1.308 N#CCC(=O)c1ccccc1Br 1P003H8B [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.308 N#CCC(=O)c1ccccc1C 1P007EE7 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.308 N#CCC(=O)c1ccccc1Cl 1P0033PU [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.308 N#CCC(=O)c1ccccc1F 1P00C7KN [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.308 N#CCC(=O)c1ccccc1O 1P0085P9 [0,2,0,0,0,0|1,0,0]=3 6968 B12R1.308 N#CNC(=O)c1ccccc1Cl 1P01BE2C [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.308 NCCC(=O)c1ccccc1N 1P0030GO [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.308 NCCC(=O)c1ccccc1N 1P01BAEY [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.308 S=C=NC(=O)c1ccccc1F 1P008Q1N [0,2,0,0,0,0|1,1,0]=4 6972 B10R1.16 Cc1ccc(o1)\C=C\C=O 1P00DIF2 [0,0,1,1,0,0|1,0,1]=4 6973 B10R1.18 OC(=O)Cc1ccccc1 1P003OC7 [0,0,1,1,0,0|1,0,1]=4 6974 B10R1.18 OC(=O)Cc1ccccn1 1P001WD0 [0,0,1,1,0,0|1,0,1]=4 6975 B10R1.18 OC(=O)Nc1ccccc1 1P007CT0 [0,0,1,1,0,0|2,0,0]=4 6976 B10R1.66 CC(=O)C=Cc1ccco1 1P00CMZ2 [0,0,1,1,0,0|1,0,0]=3 6977 B10R1.66 CC(=O)C=Cc1cccs1 1P003KH7 [0,0,1,1,0,0|1,1,0]=4 6978 B10R1.66 CC(=O)\C=C\c1ccco1 1P003KGG [0,0,1,1,0,0|1,0,0]=3 6979 B10R1.66 CC(=O)\C=C\c1cccs1 1P007DZY [0,0,1,1,0,0|1,1,0]=4 6980 B10R1.66 ClC(=O)\C=C\c1ccco1 1P00ELVO [0,0,1,1,0,0|1,0,0]=3 6981 B10R1.66 OC(=O)C=Cc1c[nH]cc1 1P0051EL [0,0,1,1,0,0|2,0,0]=4 6982 B10R1.66 OC(=O)C=Cc1c[nH]cn1 1P003IFZ [0,0,1,1,0,0|2,0,0]=4 6983 B10R1.66 OC(=O)C=Cc1c[nH]cn1 1P01AGPN [0,0,1,1,0,0|2,0,0]=4 6984 B10R1.66 OC(=O)C=Cc1ccc[nH]1 1P00DM57 [0,0,1,1,0,0|1,0,0]=3 6985 B10R1.66 OC(=O)C=Cc1ccco1 1P00DENX [0,0,1,1,0,0|0,0,0]=2 6986 B10R1.66 OC(=O)C=Cc1cccs1 1P008S57 [0,0,1,1,0,0|0,1,0]=3 6987 B10R1.66 OC(=O)C=Cc1cocc1 1P00G5E1 [0,0,1,1,0,0|2,0,0]=4 6988 B10R1.66 OC(=O)C=Cc1cscc1 1P000JD6 [0,0,1,1,0,0|2,0,0]=4 6989 B10R1.66 OC(=O)C=Cc1nccs1 1P00DMJ1 [0,0,1,1,0,0|1,1,0]=4 6990 B10R1.66 OC(=O)CCc1ccco1 1P0033XL [0,0,1,1,0,0|0,0,2]=4 6991 B10R1.66 OC(=O)\C=C/c1cnc[nH]1 1P008OSS [0,0,1,1,0,0|2,0,0]=4 6992 B10R1.66 OC(=O)\C=C/c1ncc[nH]1 1P01DZ3X [0,0,1,1,0,0|2,0,0]=4 6993 B10R1.66 OC(=O)\C=C\c1c[nH]cc1 1P019TTF [0,0,1,1,0,0|2,0,0]=4 6994 B10R1.66 OC(=O)\C=C\c1c[nH]cn1 1P0032SS [0,0,1,1,0,0|2,0,0]=4 6995 B10R1.66 OC(=O)\C=C\c1cc[nH]n1 1P01FIIH [0,0,1,1,0,0|2,0,0]=4 6996 B10R1.66 OC(=O)\C=C\c1ccco1 1P001PJ5 [0,0,1,1,0,0|0,0,0]=2 6997 B10R1.66 OC(=O)\C=C\c1cccs1 1P001PJ4 [0,0,1,1,0,0|0,1,0]=3 6998 B10R1.66 OC(=O)\C=C\c1cnco1 1P028MD8 [0,0,1,1,0,0|1,0,0]=3 6999 B10R1.66 OC(=O)\C=C\c1cncs1 1P01DTDG [0,0,1,1,0,0|1,1,0]=4 7000 B10R1.66 OC(=O)\C=C\c1cocc1 1P003IOY [0,0,1,1,0,0|2,0,0]=4 7001 B10R1.66 OC(=O)\C=C\c1cscc1 1P0008M0 [0,0,1,1,0,0|2,0,0]=4 7002 B10R1.66 OC(=O)\C=C\c1cscn1 1P00K35P [0,0,1,1,0,0|2,0,0]=4 7003 B10R1.66 OC(=O)\C=C\c1ncco1 1P01EMKW [0,0,1,1,0,0|1,0,0]=3 7004 B10R1.66 OC(=O)\C=C\c1nccs1 1P00IMQJ [0,0,1,1,0,0|1,1,0]=4 7005 B10R1.66 [O-][N+](=O)C=Cc1ccco1 1P00C65M [0,0,1,1,0,0|1,0,1]=4 7006 B10R1.66 [O-][N+](=O)\C=C\c1ccco1 1P003DB5 [0,0,1,1,0,0|1,0,1]=4 7007 B10R1.348 OC(=O)C1C=CC=CC=C1 1P01BDNG [0,0,1,1,0,0|1,0,1]=4 7008 B10R1.8 O=Cc1cc(O)cc(c1)O 1P002SCI [0,0,1,1,0,0|2,0,0]=4 7009 B10R1.54 Cc1ccc(o1)CC(=O)O 1P00VUZG [0,0,1,1,0,0|0,0,2]=4 7010 B10R1.22 Cc1cc(O)c(c(=O)o1)Br 1P002OJY [0,0,1,1,0,0|1,0,1]=4 7011 B10R1.22 Cc1cc(O)c(c(=O)o1)N 1P008I9K [0,0,1,1,0,0|1,0,1]=4 7012 B10R1.22 Cc1cc(O)c(c(=O)o1)O 1P0288PE [0,0,1,1,0,0|1,0,1]=4 7013 B10R1.23 NC(=O)C(=O)c1ccco1 1P004W01 [0,0,1,1,0,0|2,0,0]=4 7014 B10R1.23 OC(=O)C(=O)c1ccc[nH]1 1P01XFH9 [0,0,1,1,0,0|2,0,0]=4 7015 B10R1.23 OC(=O)C(=O)c1ccco1 1P001EQ0 [0,0,1,1,0,0|1,0,0]=3 7016 B10R1.23 OC(=O)C(=O)c1cccs1 1P003IAL [0,0,1,1,0,0|1,1,0]=4 7017 B10R1.23 OC(=O)C(c1ccco1)C 1P01ALA0 [0,0,1,1,0,0|0,0,2]=4 7018 B10R1.23 OC(=O)C(c1ccco1)N 1P007UOY [0,0,1,1,0,0|1,0,1]=4 7019 B10R1.23 OC(=O)[C@@H](c1ccco1)O 1P024Z1R [0,0,1,1,0,0|1,0,1]=4 7020 B10R1.23 OC(=O)[C@H](c1ccco1)O 1P0289EK [0,0,1,1,0,0|1,0,1]=4 7021 B10R1.31 CSc1occ(c1)C(=O)O 1P01C5EF [0,0,1,1,0,0|1,0,1]=4 7022 B10R1.31 N#Cc1occ(c1)C(=O)O 1P01BTZ2 [0,0,1,1,0,0|1,0,1]=4 7023 B10R1.31 NCc1occ(c1)C(=O)O 1P01AFU9 [0,0,1,1,0,0|1,0,1]=4 7024 B10R1.31 NCc1occ(c1)C(=O)O 1P01EBN9 [0,0,1,1,0,0|1,0,1]=4 7025 B10R1.31 O=Cc1[nH]cc(c1)C(=O)O 1P0280Q9 [0,0,1,1,0,0|2,0,0]=4 7026 B10R1.31 O=Cc1occ(c1)C(=O)O 1P00EWKP [0,0,1,1,0,0|1,0,0]=3 7027 B10R1.31 O=Cc1scc(c1)C(=O)O 1P00IG3F [0,0,1,1,0,0|1,1,0]=4 7028 B10R1.31 OC(=O)c1cn(nc1)C=C 1P006D5K [0,0,1,1,0,0|2,0,0]=4 7029 B10R1.31 OCc1occ(c1)C(=O)O 1P002P8R [0,0,1,1,0,0|1,0,1]=4 7030 B10R2.6 O1CC1c2ccccc2 1P003632 [1,0,0,1,0,0|1,0,1]=4 7031 B10R2.6 O1C[C@@H]1c2ccccc2 1P002JRH [1,0,0,1,0,0|1,0,1]=4 7032 B10R2.6 O1C[C@H]1c2ccccc2 1P002JRI [1,0,0,1,0,0|1,0,1]=4 7033 B10R2.320 O=C1Cc2c1cccc2 1P00C72G [1,0,0,1,0,0|1,0,0]=3 7034 B10R2.320 OC1Cc2c1cccc2 1P00CLUH [1,0,0,1,0,0|1,0,1]=4 7035 B10R2.7 C1Oc2c(O1)cccc2 1P00I5NN [1,0,0,1,0,0|2,0,0]=4 7036 B10R2.7 O1Cc2c(C1)cccc2 1P003E0J [1,0,0,1,0,0|1,0,1]=4 7037 B10R2.7 c1ccc2c(c1)C=CC2 1P0035HF [1,0,0,1,0,0|2,0,0]=4 7038 B10R2.7 c1ccc2c(c1)OCC2 1P0033EK [1,0,0,1,0,0|1,0,1]=4 7039 B10R2.7 c1ccc2c(c1)[nH]cc2 1P000QID [1,0,0,1,0,0|2,0,0]=4 7040 B10R2.7 c1ccc2c(c1)[nH]nc2 1P003RGJ [1,0,0,1,0,0|2,0,0]=4 7041 B10R2.7 c1ccc2c(c1)n[nH]c2 1P00BGNY [1,0,0,1,0,0|2,0,0]=4 7042 B10R2.7 c1ccc2c(c1)noc2 1P003FN6 [1,0,0,1,0,0|1,0,0]=3 7043 B10R2.7 c1ccc2c(c1)non2 1P003OIC [1,0,0,1,0,0|2,0,0]=4 7044 B10R2.7 c1ccc2c(c1)occ2 1P00BMCA [1,0,0,1,0,0|1,0,0]=3 7045 B10R2.7 c1ccc2c(c1)ocn2 1P0034YR [1,0,0,1,0,0|2,0,0]=4 7046 B10R2.7 c1ccc2c(c1)onc2 1P003DSK [1,0,0,1,0,0|1,0,0]=3 7047 B10R2.7 c1ccc2c(c1)scc2 1P0034YI [1,0,0,1,0,0|1,1,0]=4 7048 B10R2.7 c1ccc2c(c1)snc2 1P00BIAE [1,0,0,1,0,0|1,1,0]=4 7049 B10R2.7 c1cnc2c(c1)cco2 1P007M4K [1,0,0,1,0,0|2,0,0]=4 7050 B10R2.7 c1cnc2c(c1)occ2 1P00C2OS [1,0,0,1,0,0|2,0,0]=4 7051 B10R2.7 c1ncc2c(c1)cco2 1P00AQNP [1,0,0,1,0,0|2,0,0]=4 7052 B10R2.7 c1ncc2c(c1)occ2 1P00C37P [1,0,0,1,0,0|2,0,0]=4 7053 B12R2.24 C1Oc2ccncc2NC1=O 1P0007G7 [0,0,0,1,0,1|2,0,0]=4 7054 B12R2.24 C1Oc2ncccc2NC1=O 1P0012RC [0,0,0,1,0,1|2,0,0]=4 7055 B12R2.24 O=C1CCc2c(N1)cccc2 1P003IXY [0,0,0,1,0,1|2,0,0]=4 7056 B12R2.24 O=C1CCc2c(O1)cccc2 1P000PG9 [0,0,0,1,0,1|2,0,0]=4 7057 B12R2.24 O=C1CNc2c(N1)cccc2 1P00EBBL [0,0,0,1,0,1|2,0,0]=4 7058 B12R2.24 O=C1COc2c(C1)cccc2 1P002FDL [0,0,0,1,0,1|1,0,0]=3 7059 B12R2.24 O=C1COc2c(N1)cccc2 1P003HTH [0,0,0,1,0,1|1,0,0]=3 7060 B12R2.24 O=C1COc2c(N1)ccnc2 1P00AT1V [0,0,0,1,0,1|2,0,0]=4 7061 B12R2.24 O=C1COc2c(N1)nccc2 1P0029DK [0,0,0,1,0,1|2,0,0]=4 7062 B12R2.24 O=C1COc2c(O1)cccc2 1P00DUNM [0,0,0,1,0,1|1,0,0]=3 7063 B12R2.24 O=C1CSc2c(C1)cccc2 1P001YUW [0,0,0,1,0,1|1,1,0]=4 7064 B12R2.24 O=C1CSc2c(N1)cccc2 1P003HTJ [0,0,0,1,0,1|1,1,0]=4 7065 B12R2.24 O=C1NCc2c(C1)cccc2 1P00C3UR [0,0,0,1,0,1|2,0,0]=4 7066 B12R2.24 O=C1NCc2c(N1)cccc2 1P00FGZ1 [0,0,0,1,0,1|2,0,0]=4 7067 B12R2.24 O=C1NCc2c(O1)cccc2 1P009OMZ [0,0,0,1,0,1|2,0,0]=4 7068 B12R2.24 O=C1OCc2c(C1)cccc2 1P00I8TK [0,0,0,1,0,1|1,0,0]=3 7069 B12R2.24 O=C1OCc2c(N1)cccc2 1P00AGC8 [0,0,0,1,0,1|1,0,0]=3 7070 B12R2.24 O=c1[nH]cc2c(c1)cccc2 1P00AIWV [0,0,0,1,0,1|2,0,0]=4 7071 B12R2.24 O=c1ccc2c(o1)cccc2 1P00IGUT [0,0,0,1,0,1|2,0,0]=4 7072 B12R2.24 O=c1cnc2c([nH]1)cccc2 1P000PQ3 [0,0,0,1,0,1|2,0,0]=4 7073 B12R2.24 O=c1cnc2c(o1)cccc2 1P027VQP [0,0,0,1,0,1|2,0,0]=4 7074 B12R2.24 Oc1ccc2c(c1)cccc2 1P0033VA [0,0,0,1,0,1|2,0,0]=4 7075 B12R2.24 Oc1cnc2c(c1)cccc2 1P00346Y [0,0,0,1,0,1|2,0,0]=4 7076 B12R2.24 Oc1ncc2c(c1)cccc2 1P00346S [0,0,0,1,0,1|2,0,0]=4 7077 B12R2.24 Oc1ncc2c(n1)cccc2 1P00FHGS [0,0,0,1,0,1|2,0,0]=4 7078 B12R2.24 Oc1nnc2c(c1)cccc2 1P00CJBO [0,0,0,1,0,1|2,0,0]=4 7079 B12R2.95 O=S1(=O)Oc2c(O1)cccc2 1P0075UW [0,0,0,1,0,1|1,0,1]=4 7080 B12R2.202 Brc1oc2c(n1)c(F)ccc2 1P01DVWT [0,0,0,1,0,1|2,0,0]=4 7081 B12R2.202 Brc1sc2c(c1)c(O)ccc2 1P01B7F6 [0,0,0,1,0,1|1,1,0]=4 7082 B12R2.202 Brc1sc2c(n1)c(O)ccc2 1P000RAE [0,0,0,1,0,1|1,1,0]=4 7083 B12R2.202 Cc1cc2c([nH]1)cccc2O 1P003I1Y [0,0,0,1,0,1|2,0,0]=4 7084 B12R2.202 Cc1cc2c(o1)c(O)ccc2 1P024Z0L [0,0,0,1,0,1|2,0,0]=4 7085 B12R2.202 Cc1nc2c([nH]1)cccc2O 1P00IJ4S [0,0,0,1,0,1|2,0,0]=4 7086 B12R2.202 Cc1nc2c(o1)cccc2C 1P003GB1 [0,0,0,1,0,1|2,0,0]=4 7087 B12R2.202 Cc1oc2c(c1)c(Br)ccc2 1P01BDGU [0,0,0,1,0,1|2,0,0]=4 7088 B12R2.202 Cc1oc2c(n1)c(Br)ccc2 1P00BIW6 [0,0,0,1,0,1|2,0,0]=4 7089 B12R2.202 Cc1oc2c(n1)c(F)ccc2 1P01DDFL [0,0,0,1,0,1|2,0,0]=4 7090 B12R2.202 Cc1oc2c(n1)c(N)ccc2 1P003AOK [0,0,0,1,0,1|2,0,0]=4 7091 B12R2.202 Cc1oc2c(n1)c(O)ccc2 1P01AGK0 [0,0,0,1,0,1|1,0,0]=3 7092 B12R2.202 Cc1sc2c(n1)c(O)ccc2 1P00IJ4R [0,0,0,1,0,1|1,1,0]=4 7093 B12R2.202 Clc1nc2c(s1)c(O)ccc2 1P003AO8 [0,0,0,1,0,1|2,0,0]=4 7094 B12R2.202 Clc1oc2c(n1)c(Br)ccc2 1P000V07 [0,0,0,1,0,1|2,0,0]=4 7095 B12R2.202 Clc1oc2c(n1)c(C)ccc2 1P009220 [0,0,0,1,0,1|2,0,0]=4 7096 B12R2.202 Clc1oc2c(n1)c(F)ccc2 1P000CMJ [0,0,0,1,0,1|2,0,0]=4 7097 B12R2.202 Nc1nc2c([nH]1)cccc2O 1P01XGGW [0,0,0,1,0,1|2,0,0]=4 7098 B12R2.202 Nc1nc2c(s1)c(O)ccc2 1P00EP93 [0,0,0,1,0,1|2,0,0]=4 7099 B12R2.202 Nc1oc2c(n1)c(Br)ccc2 1P0022NV [0,0,0,1,0,1|2,0,0]=4 7100 B12R2.202 Nc1oc2c(n1)c(C)ccc2 1P00IIYX [0,0,0,1,0,1|2,0,0]=4 7101 B12R2.202 Nc1oc2c(n1)c(F)ccc2 1P00I0M0 [0,0,0,1,0,1|2,0,0]=4 7102 B12R2.202 Nc1oc2c(n1)c(O)ccc2 1P00IKL6 [0,0,0,1,0,1|1,0,0]=3 7103 B12R2.202 Nc1sc2c(n1)c(O)ccc2 1P00ID0J [0,0,0,1,0,1|1,1,0]=4 7104 B12R2.202 O=C1C=c2c(=N1)c(C)ccc2 1P0078DY [0,0,0,1,0,1|2,0,0]=4 7105 B12R2.202 O=C1Cc2c(C1)cccc2Br 1P0038V7 [0,0,0,1,0,1|2,0,0]=4 7106 B12R2.202 O=C1Cc2c(C1)cccc2Cl 1P0036Z2 [0,0,0,1,0,1|2,0,0]=4 7107 B12R2.202 O=C1Cc2c(C1)cccc2F 1P008UUM [0,0,0,1,0,1|2,0,0]=4 7108 B12R2.202 O=C1Cc2c(N1)c(Br)ccc2 1P0037U6 [0,0,0,1,0,1|2,0,0]=4 7109 B12R2.202 O=C1Cc2c(N1)c(Cl)ccc2 1P006VKK [0,0,0,1,0,1|2,0,0]=4 7110 B12R2.202 O=C1Cc2c(N1)c(F)ccc2 1P0034V0 [0,0,0,1,0,1|2,0,0]=4 7111 B12R2.202 O=C1Cc2c(N1)c(N)ccc2 1P007NUN [0,0,0,1,0,1|2,0,0]=4 7112 B12R2.202 O=C1Cc2c(O1)c(Br)ccc2 1P0290AL [0,0,0,1,0,1|2,0,0]=4 7113 B12R2.202 O=C1Cc2c(O1)c(Cl)ccc2 1P0286FY [0,0,0,1,0,1|2,0,0]=4 7114 B12R2.202 O=C1Nc2c(C1)c(Br)ccc2 1P0034F9 [0,0,0,1,0,1|2,0,0]=4 7115 B12R2.202 O=C1Nc2c(C1)c(C)ccc2 1P0010TH [0,0,0,1,0,1|2,0,0]=4 7116 B12R2.202 O=C1Nc2c(C1)c(Cl)ccc2 1P002KBE [0,0,0,1,0,1|2,0,0]=4 7117 B12R2.202 O=C1Nc2c(C1)c(F)ccc2 1P00191Z [0,0,0,1,0,1|2,0,0]=4 7118 B12R2.202 O=C1Nc2c(C1)c(I)ccc2 1P0027IT [0,0,0,1,0,1|2,0,0]=4 7119 B12R2.202 O=C1Nc2c(C1)c(N)ccc2 1P00DGLJ [0,0,0,1,0,1|2,0,0]=4 7120 B12R2.202 O=C1Nc2c(C1)c(N)ccc2 1P028EB4 [0,0,0,1,0,1|2,0,0]=4 7121 B12R2.202 O=C1Nc2c(C1)c(O)ccc2 1P0071F2 [0,0,0,1,0,1|1,0,0]=3 7122 B12R2.202 O=C1Nc2c(C1)c(O)ccn2 1P000HY0 [0,0,0,1,0,1|2,0,0]=4 7123 B12R2.202 O=C1Oc2c(C1)c(Br)ccc2 1P0202LA [0,0,0,1,0,1|1,0,0]=3 7124 B12R2.202 O=c1[nH]c2c([nH]1)cccc2Br 1P00CNEO [0,0,0,1,0,1|2,0,0]=4 7125 B12R2.202 O=c1[nH]c2c([nH]1)cccc2C 1P002G0O [0,0,0,1,0,1|2,0,0]=4 7126 B12R2.202 O=c1[nH]c2c([nH]1)cccc2F 1P00BJ2J [0,0,0,1,0,1|2,0,0]=4 7127 B12R2.202 O=c1[nH]c2c([nH]1)cccc2N 1P005YGQ [0,0,0,1,0,1|2,0,0]=4 7128 B12R2.202 O=c1[nH]c2c([nH]1)cccc2O 1P00FGYI [0,0,0,1,0,1|1,0,0]=3 7129 B12R2.202 O=c1oc2c([nH]1)c(Br)ccc2 1P01E9LU [0,0,0,1,0,1|1,0,0]=3 7130 B12R2.202 O=c1oc2c([nH]1)c(F)ccc2 1P00ELTP [0,0,0,1,0,1|1,0,0]=3 7131 B12R2.202 O=c1oc2c([nH]1)c(N)ccc2 1P005HGW [0,0,0,1,0,1|1,0,0]=3 7132 B12R2.202 O=c1oc2c([nH]1)c(O)ccc2 1P002VG9 [0,0,0,1,0,1|0,0,0]=2 7133 B12R2.202 O=c1oc2c([nH]1)cccc2Br 1P0036TT [0,0,0,1,0,1|2,0,0]=4 7134 B12R2.202 O=c1oc2c([nH]1)cccc2C 1P0074EM [0,0,0,1,0,1|2,0,0]=4 7135 B12R2.202 O=c1oc2c([nH]1)cccc2F 1P00DLSK [0,0,0,1,0,1|2,0,0]=4 7136 B12R2.202 O=c1oc2c([nH]1)cccc2N 1P005LV5 [0,0,0,1,0,1|2,0,0]=4 7137 B12R2.202 O=c1sc2c([nH]1)c(C)ccc2 1P005EH4 [0,0,0,1,0,1|1,1,0]=4 7138 B12R2.202 O=c1sc2c([nH]1)c(Cl)ccc2 1P00BXS8 [0,0,0,1,0,1|1,1,0]=4 7139 B12R2.202 O=c1sc2c([nH]1)c(F)ccc2 1P00EDK2 [0,0,0,1,0,1|1,1,0]=4 7140 B12R2.202 O=c1sc2c([nH]1)cccc2Br 1P007Q16 [0,0,0,1,0,1|2,0,0]=4 7141 B12R2.202 O=c1sc2c([nH]1)cccc2C 1P00GRC6 [0,0,0,1,0,1|2,0,0]=4 7142 B12R2.202 O=c1sc2c([nH]1)cccc2Cl 1P00G5H4 [0,0,0,1,0,1|2,0,0]=4 7143 B12R2.202 O=c1sc2c([nH]1)cccc2F 1P01ANR8 [0,0,0,1,0,1|2,0,0]=4 7144 B12R2.202 S=c1oc2c([nH]1)c(O)ccc2 1P003LZV [0,0,0,1,0,1|0,1,0]=3 7145 B12R2.202 Sc1oc2c(n1)c(C)ccc2 1P00J7L9 [0,0,0,1,0,1|1,1,0]=4 7146 B12R2.202 Sc1oc2c(n1)c(F)ccc2 1P01BF4M [0,0,0,1,0,1|1,1,0]=4 7147 B12R2.3190 CC(=O)C1Cc2c1cccc2 1P009LOJ [0,0,0,1,0,1|2,0,0]=4 7148 B12R2.3190 ClC(=O)C1Cc2c1cccc2 1P001F99 [0,0,0,1,0,1|2,0,0]=4 7149 B12R2.3190 OC(=O)C1Cc2c1cccc2 1P001IVS [0,0,0,1,0,1|1,0,0]=3 7150 B12R2.1081 O=C1CCCc2c1cccc2 1P0033AS [0,1,0,1,0,0|2,0,0]=4 7151 B12R2.1081 O=C1CCNc2c1cccc2 1P0033EM [0,1,0,1,0,0|2,0,0]=4 7152 B12R2.1081 O=C1CCNc2c1cccc2 1P00BXYO [0,1,0,1,0,0|2,0,0]=4 7153 B12R2.1081 O=C1CCOC2=C1C=CN=C2 1P01KE4T [0,1,0,1,0,0|2,0,0]=4 7154 B12R2.1081 O=C1CCOc2c1cccc2 1P0034H7 [0,1,0,1,0,0|1,0,0]=3 7155 B12R2.1081 O=C1CCOc2c1cccn2 1P009394 [0,1,0,1,0,0|2,0,0]=4 7156 B12R2.1081 O=C1CCOc2c1cncc2 1P006410 [0,1,0,1,0,0|2,0,0]=4 7157 B12R2.1081 O=C1CCOc2c1nccc2 1P0077EN [0,1,0,1,0,0|2,0,0]=4 7158 B12R2.1081 O=C1CCSc2c1cccc2 1P003V8V [0,1,0,1,0,0|1,1,0]=4 7159 B12R2.1081 O=C1CNNc2c1cccc2 1P0013DI [0,1,0,1,0,0|2,0,0]=4 7160 B12R2.1081 O=C1COCc2c1cccc2 1P002KKX [0,1,0,1,0,0|1,0,0]=3 7161 B12R2.1081 O=C1COCc2c1cccn2 1P000OXM [0,1,0,1,0,0|2,0,0]=4 7162 B12R2.1081 O=C1COCc2c1cncc2 1P0209BP [0,1,0,1,0,0|2,0,0]=4 7163 B12R2.1081 O=C1COCc2c1nccc2 1P028MQP [0,1,0,1,0,0|2,0,0]=4 7164 B12R2.1081 O=C1CSCc2c1cccc2 1P003RMB [0,1,0,1,0,0|1,1,0]=4 7165 B12R2.1081 O=C1NCCc2c1cccc2 1P000PPA [0,1,0,1,0,0|2,0,0]=4 7166 B12R2.1081 O=C1NNCc2c1cccc2 1P01EKGA [0,1,0,1,0,0|2,0,0]=4 7167 B12R2.1081 O=C1OCCc2c1cccc2 1P003IXX [0,1,0,1,0,0|1,0,0]=3 7168 B12R2.1081 O=S1CCOc2c1cccc2 1P01FL79 [0,1,0,1,0,0|2,0,0]=4 7169 B12R2.1081 O=c1[nH]ccc2c1cccc2 1P00I9AL [0,1,0,1,0,0|2,0,0]=4 7170 B12R2.1081 O=c1[nH]cnc2c1cccc2 1P0010ZL [0,1,0,1,0,0|2,0,0]=4 7171 B12R2.1081 O=c1[nH]ncc2c1cccc2 1P003BFV [0,1,0,1,0,0|2,0,0]=4 7172 B12R2.1081 O=c1[nH]nnc2c1cccc2 1P003IY6 [0,1,0,1,0,0|2,0,0]=4 7173 B12R2.1081 O=c1cc[nH]c2c1cccc2 1P00D9NO [0,1,0,1,0,0|2,0,0]=4 7174 B12R2.1081 O=c1ccoc2c1cccc2 1P00DADV [0,1,0,1,0,0|1,0,0]=3 7175 B12R2.1081 O=c1ccoc2c1ccnc2 1P0287EG [0,1,0,1,0,0|2,0,0]=4 7176 B12R2.1081 O=c1ccoc2c1nccc2 1P01BSIM [0,1,0,1,0,0|2,0,0]=4 7177 B12R2.1081 O=c1cn[nH]c2c1cccc2 1P007S2H [0,1,0,1,0,0|2,0,0]=4 7178 B12R2.1081 O=c1occc2c1cccc2 1P00DKD7 [0,1,0,1,0,0|1,0,0]=3 7179 B12R2.1081 O=c1occc2c1nccc2 1P007MRJ [0,1,0,1,0,0|2,0,0]=4 7180 B12R2.1081 OC1CCOc2c1cccc2 1P001FWV [0,1,0,1,0,0|1,0,1]=4 7181 B12R2.1081 OC1COCc2c1cccc2 1P002KKW [0,1,0,1,0,0|1,0,1]=4 7182 B12R2.1081 O[C@@H]1CCOc2c1cccc2 1P009980 [0,1,0,1,0,0|1,0,1]=4 7183 B12R2.1081 O[C@H]1CCOc2c1cccc2 1P0011AH [0,1,0,1,0,0|1,0,1]=4 7184 B12R2.1081 Oc1ccnc2c1cccc2 1P0034JA [0,1,0,1,0,0|2,0,0]=4 7185 B12R2.1081 Oc1cncc2c1cccc2 1P0038HZ [0,1,0,1,0,0|2,0,0]=4 7186 B12R2.1081 Oc1cnnc2c1cccc2 1P004JPW [0,1,0,1,0,0|2,0,0]=4 7187 B12R2.1081 Oc1cnnc2c1cccc2 1P019P4D [0,1,0,1,0,0|2,0,0]=4 7188 B12R2.2028 C=C1OC(=O)c2c1cccn2 1P0282ZQ [0,1,0,1,0,0|2,0,0]=4 7189 B12R2.2028 CC1OB(c2c1cccc2)O 1P01BX4T [0,1,0,1,0,0|1,0,1]=4 7190 B12R2.2028 CC1OC(=O)c2c1nccc2 1P01C26A [0,1,0,1,0,0|2,0,0]=4 7191 B12R2.2028 C[C@@H]1OB(c2c1cccc2)O 1P027XQO [0,1,0,1,0,0|1,0,1]=4 7192 B12R2.2028 C[C@H]1OB(c2c1cccc2)O 1P0292LN [0,1,0,1,0,0|1,0,1]=4 7193 B12R2.2028 Cn1[nH]c(=O)c2c1cccc2 1P0002WW [0,1,0,1,0,0|2,0,0]=4 7194 B12R2.2028 O=C1C=C(c2c1cccc2)Br 1P01GZU2 [0,1,0,1,0,0|2,0,0]=4 7195 B12R2.2028 O=C1CC(=O)c2c1cccc2 1P00332Q [0,1,0,1,0,0|1,0,1]=4 7196 B12R2.2028 O=C1CC(c2c1cccc2)Br 1P003JG9 [0,1,0,1,0,0|2,0,0]=4 7197 B12R2.2028 O=C1CC(c2c1cccc2)C 1P003K5N [0,1,0,1,0,0|2,0,0]=4 7198 B12R2.2028 O=C1CC(c2c1cccc2)N 1P00ADCH [0,1,0,1,0,0|2,0,0]=4 7199 B12R2.2028 O=C1C[C@@H](c2c1cccc2)C 1P01EKBH [0,1,0,1,0,0|2,0,0]=4 7200 B12R2.2028 O=C1C[C@H](c2c1cccc2)C 1P005GL2 [0,1,0,1,0,0|2,0,0]=4 7201 B12R2.2028 O=C1NC(=N)c2c1cccc2 1P007KI2 [0,1,0,1,0,0|2,0,0]=4 7202 B12R2.2028 O=C1NC(=O)c2c1cccc2 1P0035Y6 [0,1,0,1,0,0|1,0,1]=4 7203 B12R2.2028 O=C1NC(=O)c2c1cccc2 1P0035ZD [0,1,0,1,0,0|1,0,1]=4 7204 B12R2.2028 O=C1NC(c2c1cccc2)C 1P01DYOU [0,1,0,1,0,0|2,0,0]=4 7205 B12R2.2028 O=C1NC(c2c1cccc2)N 1P00II77 [0,1,0,1,0,0|2,0,0]=4 7206 B12R2.2028 O=C1N[C@@H](c2c1cccc2)C 1P000ZYL [0,1,0,1,0,0|2,0,0]=4 7207 B12R2.2028 O=C1OC(=O)c2c1cccc2 1P0036V9 [0,1,0,1,0,0|0,0,1]=3 7208 B12R2.2028 O=C1OC(=O)c2c1cncc2 1P003UJ7 [0,1,0,1,0,0|1,0,1]=4 7209 B12R2.2028 O=C1OC(=O)c2c1nccc2 1P005RZ5 [0,1,0,1,0,0|1,0,1]=4 7210 B12R2.2028 O=C1OC(c2c1cccc2)Br 1P003JLP [0,1,0,1,0,0|1,0,0]=3 7211 B12R2.2028 O=C1OC(c2c1cccc2)C 1P003B0H [0,1,0,1,0,0|1,0,0]=3 7212 B12R2.2028 O=C1OC(c2c1cccc2)Cl 1P00IBKW [0,1,0,1,0,0|1,0,0]=3 7213 B12R2.2028 O=C1OC(c2c1cccc2)O 1P001YMT [0,1,0,1,0,0|0,0,0]=2 7214 B12R2.2028 O=C1OC(c2c1cccc2)O 1P019PMD [0,1,0,1,0,0|0,0,0]=2 7215 B12R2.2028 O=C1O[I](c2c1cccc2)O 1P000VS1 [0,1,0,1,0,0|0,0,0]=2 7216 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O 1P0289PZ [0,1,0,1,0,0|1,0,1]=4 7217 B12R2.2048 COc1ccccc1C2CO2 1P00EKBO [0,1,0,1,0,0|1,0,1]=4 7218 B12R2.2048 COc1ccccc1[C@H]2CO2 1P003D1X [0,1,0,1,0,0|1,0,1]=4 7219 B12R2.2403 OP1(=O)OCc2c1cccc2 1P028I0P [0,1,0,1,0,0|1,0,0]=3 7220 B12R2.88 Oc1ccccc1C2(O)CC2 1P0288NF [0,1,0,1,0,0|1,0,1]=4 7221 B12R2.203 Brc1cccc2c1c(=O)[nH][nH]2 1P003LBK [0,1,0,1,0,0|2,0,0]=4 7222 B12R2.203 Brc1cccc2c1c(=O)[nH]s2 1P020L19 [0,1,0,1,0,0|1,1,0]=4 7223 B12R2.203 Brc1cccc2c1c(Br)co2 1P028LW4 [0,1,0,1,0,0|2,0,0]=4 7224 B12R2.203 Brc1cccc2c1c(C)no2 1P01K15H [0,1,0,1,0,0|2,0,0]=4 7225 B12R2.203 Brc1cccc2c1c(Cl)no2 1P00A69P [0,1,0,1,0,0|2,0,0]=4 7226 B12R2.203 Brc1cccc2c1c(N)no2 1P005J36 [0,1,0,1,0,0|2,0,0]=4 7227 B12R2.203 Cc1c[nH]c2c1c(O)ccc2 1P009RGD [0,1,0,1,0,0|2,0,0]=4 7228 B12R2.203 Cc1cccc2c1c(N)no2 1P0082IK [0,1,0,1,0,0|2,0,0]=4 7229 B12R2.203 Cc1coc2c1c(O)ccc2 1P024YYF [0,1,0,1,0,0|1,0,0]=3 7230 B12R2.203 Clc1cccc2c1c(=O)[nH][nH]2 1P008MIN [0,1,0,1,0,0|2,0,0]=4 7231 B12R2.203 Clc1cccc2c1c(N)no2 1P00IEOP [0,1,0,1,0,0|2,0,0]=4 7232 B12R2.203 Fc1cccc2c1c(=O)[nH][nH]2 1P00FAOV [0,1,0,1,0,0|2,0,0]=4 7233 B12R2.203 Fc1cccc2c1c(=O)[nH]o2 1P0026QZ [0,1,0,1,0,0|1,0,0]=3 7234 B12R2.203 Fc1cccc2c1c(N)no2 1P00IGMD [0,1,0,1,0,0|2,0,0]=4 7235 B12R2.203 Ic1cccc2c1c(N)no2 1P00943P [0,1,0,1,0,0|2,0,0]=4 7236 B12R2.203 Nc1cccc2c1c(O)n[nH]2 1P003ZUJ [0,1,0,1,0,0|2,0,0]=4 7237 B12R2.203 O=C1CCc2c1c(Br)ccc2 1P000NOQ [0,1,0,1,0,0|2,0,0]=4 7238 B12R2.203 O=C1CCc2c1c(C)ccc2 1P0078K9 [0,1,0,1,0,0|2,0,0]=4 7239 B12R2.203 O=C1CCc2c1c(Cl)ccc2 1P00399P [0,1,0,1,0,0|2,0,0]=4 7240 B12R2.203 O=C1CCc2c1c(F)ccc2 1P003NVW [0,1,0,1,0,0|2,0,0]=4 7241 B12R2.203 O=C1CCc2c1c(I)ccc2 1P019G9U [0,1,0,1,0,0|2,0,0]=4 7242 B12R2.203 O=C1CCc2c1c(N)ccc2 1P00EIV1 [0,1,0,1,0,0|2,0,0]=4 7243 B12R2.203 O=C1CCc2c1c(O)ccc2 1P005JMV [0,1,0,1,0,0|1,0,0]=3 7244 B12R2.203 O=C1COc2c1c(Br)ccc2 1P00072T [0,1,0,1,0,0|1,0,0]=3 7245 B12R2.203 O=C1COc2c1c(Cl)ccc2 1P00C0M1 [0,1,0,1,0,0|1,0,0]=3 7246 B12R2.203 O=C1COc2c1c(F)ccc2 1P00IGZL [0,1,0,1,0,0|1,0,0]=3 7247 B12R2.203 O=C1COc2c1c(I)ccc2 1P000QF8 [0,1,0,1,0,0|1,0,0]=3 7248 B12R2.203 O=C1COc2c1c(O)ccc2 1P00AKRK [0,1,0,1,0,0|0,0,0]=2 7249 B12R2.203 O=C1N=Cc2c1c(I)ccc2 1P004OYI [0,1,0,1,0,0|2,0,0]=4 7250 B12R2.203 O=C1NCc2c1c(Br)ccc2 1P0074UH [0,1,0,1,0,0|2,0,0]=4 7251 B12R2.203 O=C1NCc2c1c(C)ccc2 1P00F86G [0,1,0,1,0,0|2,0,0]=4 7252 B12R2.203 O=C1NCc2c1c(Cl)ccc2 1P00FGYS [0,1,0,1,0,0|2,0,0]=4 7253 B12R2.203 O=C1NCc2c1c(F)ccc2 1P000S77 [0,1,0,1,0,0|2,0,0]=4 7254 B12R2.203 O=C1NCc2c1c(N)ccc2 1P001YWU [0,1,0,1,0,0|2,0,0]=4 7255 B12R2.203 O=C1NCc2c1c(O)ccc2 1P0099KJ [0,1,0,1,0,0|1,0,0]=3 7256 B12R2.203 O=C1OCc2c1c(Br)ccc2 1P007G0U [0,1,0,1,0,0|1,0,0]=3 7257 B12R2.203 O=C1OCc2c1c(Cl)ccc2 1P003NVI [0,1,0,1,0,0|1,0,0]=3 7258 B12R2.203 O=C1OCc2c1c(Cl)ncc2 1P01KHMO [0,1,0,1,0,0|2,0,0]=4 7259 B12R2.203 O=C1OCc2c1c(F)ccc2 1P00BJT9 [0,1,0,1,0,0|1,0,0]=3 7260 B12R2.203 O=C1OCc2c1c(I)ccc2 1P01G0VX [0,1,0,1,0,0|1,0,0]=3 7261 B12R2.203 O=C1OCc2c1c(N)ccc2 1P0034UF [0,1,0,1,0,0|1,0,0]=3 7262 B12R2.203 Oc1cccc2c1c(Br)cs2 1P01B2DB [0,1,0,1,0,0|1,1,0]=4 7263 B12R2.203 Oc1cccc2c1c(C)n[nH]2 1P001LU1 [0,1,0,1,0,0|2,0,0]=4 7264 B12R2.203 Oc1cccc2c1c(I)n[nH]2 1P000MYJ [0,1,0,1,0,0|2,0,0]=4 7265 B12R2.196 Brc1cccc2c1[nH]nc2O 1P004ESH [0,1,0,1,0,0|2,0,0]=4 7266 B12R2.196 Brc1cccc2c1o[nH]c2=O 1P00DLTS [0,1,0,1,0,0|1,0,0]=3 7267 B12R2.196 Brc1cccc2c1onc2C 1P01FSJH [0,1,0,1,0,0|2,0,0]=4 7268 B12R2.196 Brc1cccc2c1onc2Cl 1P000RJE [0,1,0,1,0,0|2,0,0]=4 7269 B12R2.196 Brc1cccc2c1onc2N 1P000RXL [0,1,0,1,0,0|2,0,0]=4 7270 B12R2.196 Cc1cccc2c1o[nH]c2=O 1P007ASI [0,1,0,1,0,0|1,0,0]=3 7271 B12R2.196 Cc1coc2c1cccc2Br 1P00I5TN [0,1,0,1,0,0|2,0,0]=4 7272 B12R2.196 Cc1coc2c1cccc2Cl 1P0292NB [0,1,0,1,0,0|2,0,0]=4 7273 B12R2.196 Cc1coc2c1cccc2N 1P028A8J [0,1,0,1,0,0|2,0,0]=4 7274 B12R2.196 Clc1cccc2c1onc2N 1P00IHRS [0,1,0,1,0,0|2,0,0]=4 7275 B12R2.196 Clc1cccc2c1s[nH]c2=O 1P028E96 [0,1,0,1,0,0|1,1,0]=4 7276 B12R2.196 O=C1CCc2c1cccc2Br 1P001NLE [0,1,0,1,0,0|2,0,0]=4 7277 B12R2.196 O=C1CCc2c1cccc2C 1P002PDZ [0,1,0,1,0,0|2,0,0]=4 7278 B12R2.196 O=C1CCc2c1cccc2Cl 1P001NLF [0,1,0,1,0,0|2,0,0]=4 7279 B12R2.196 O=C1CCc2c1cccc2F 1P0034HL [0,1,0,1,0,0|2,0,0]=4 7280 B12R2.196 O=C1CCc2c1cccc2I 1P003FZN [0,1,0,1,0,0|2,0,0]=4 7281 B12R2.196 O=C1CCc2c1cccc2N 1P00AUZ3 [0,1,0,1,0,0|2,0,0]=4 7282 B12R2.196 O=C1CCc2c1cccc2N 1P00D8HO [0,1,0,1,0,0|2,0,0]=4 7283 B12R2.196 O=C1CCc2c1cccc2O 1P0034IZ [0,1,0,1,0,0|2,0,0]=4 7284 B12R2.196 O=C1COc2c1cccc2Br 1P00386M [0,1,0,1,0,0|1,0,0]=3 7285 B12R2.196 O=C1COc2c1cccc2C 1P003NX7 [0,1,0,1,0,0|1,0,0]=3 7286 B12R2.196 O=C1COc2c1cccc2Cl 1P00I6NG [0,1,0,1,0,0|1,0,0]=3 7287 B12R2.196 O=C1NCc2c1cccc2Br 1P00BYY9 [0,1,0,1,0,0|2,0,0]=4 7288 B12R2.196 O=C1NCc2c1cccc2C 1P00EKGZ [0,1,0,1,0,0|2,0,0]=4 7289 B12R2.196 O=C1NCc2c1cccc2Cl 1P008FNR [0,1,0,1,0,0|2,0,0]=4 7290 B12R2.196 O=C1NCc2c1cccc2F 1P00CLF9 [0,1,0,1,0,0|2,0,0]=4 7291 B12R2.196 O=C1NCc2c1cccc2N 1P00C8VX [0,1,0,1,0,0|2,0,0]=4 7292 B12R2.196 O=C1NCc2c1cccc2O 1P00C750 [0,1,0,1,0,0|2,0,0]=4 7293 B12R2.196 O=C1OCc2c1cccc2Br 1P0007MX [0,1,0,1,0,0|1,0,0]=3 7294 B12R2.196 O=C1OCc2c1cccc2Cl 1P003LOX [0,1,0,1,0,0|1,0,0]=3 7295 B12R2.196 O=C1OCc2c1cccc2N 1P00ED9P [0,1,0,1,0,0|1,0,0]=3 7296 B12R2.196 O=C1OCc2c1cccc2O 1P000ZZ2 [0,1,0,1,0,0|1,0,0]=3 7297 B12R2.196 OC1COc2c1cccc2Br 1P001CV8 [0,1,0,1,0,0|1,0,1]=4 7298 B12R2.196 OC1COc2c1cccc2Cl 1P00OVNQ [0,1,0,1,0,0|1,0,1]=4 7299 B12R2.612 Brc1ccc2c(c1)C=CC2=O 1P00CXV1 [0,1,0,1,0,0|2,0,0]=4 7300 B12R2.612 Brc1ccc2c(c1)CCC2=O 1P0034OZ [0,1,0,1,0,0|2,0,0]=4 7301 B12R2.612 Brc1ccc2c(c1)CNC2=O 1P003MX2 [0,1,0,1,0,0|2,0,0]=4 7302 B12R2.612 Brc1ccc2c(c1)COC2=O 1P0034P4 [0,1,0,1,0,0|1,0,0]=3 7303 B12R2.612 Brc1ccc2c(c1)OCC2=O 1P0028BO [0,1,0,1,0,0|1,0,0]=3 7304 B12R2.612 Brc1ccc2c(c1)OCC2O 1P00HVXP [0,1,0,1,0,0|1,0,1]=4 7305 B12R2.612 Brc1ccc2c(c1)[nH]nc2O 1P004D5W [0,1,0,1,0,0|2,0,0]=4 7306 B12R2.612 Brc1ccc2c(c1)o[nH]c2=O 1P00FDME [0,1,0,1,0,0|1,0,0]=3 7307 B12R2.612 Brc1ccc2c(c1)occ2C 1P00CL0U [0,1,0,1,0,0|2,0,0]=4 7308 B12R2.612 Brc1ccc2c(c1)onc2C 1P0037AQ [0,1,0,1,0,0|2,0,0]=4 7309 B12R2.612 Brc1ccc2c(c1)onc2Cl 1P000MCD [0,1,0,1,0,0|2,0,0]=4 7310 B12R2.612 Brc1ccc2c(c1)onc2N 1P00265J [0,1,0,1,0,0|2,0,0]=4 7311 B12R2.612 Brc1ccc2c(c1)snc2O 1P027TA2 [0,1,0,1,0,0|1,1,0]=4 7312 B12R2.612 Brc1ccc2c(n1)COC2=O 1P028UDG [0,1,0,1,0,0|2,0,0]=4 7313 B12R2.612 Brc1cnc2c(c1)OCC2=O 1P01B9LK [0,1,0,1,0,0|2,0,0]=4 7314 B12R2.612 Brc1cnc2c(c1)OCC2=O 1P01BAPP [0,1,0,1,0,0|2,0,0]=4 7315 B12R2.612 Cc1ccc2c(c1)CCC2=O 1P00DEZN [0,1,0,1,0,0|2,0,0]=4 7316 B12R2.612 Cc1ccc2c(c1)CNC2=O 1P006S5G [0,1,0,1,0,0|2,0,0]=4 7317 B12R2.612 Cc1ccc2c(c1)COC2=O 1P00DKZ1 [0,1,0,1,0,0|1,0,0]=3 7318 B12R2.612 Cc1ccc2c(c1)OCC2=O 1P00BJS5 [0,1,0,1,0,0|1,0,0]=3 7319 B12R2.612 Cc1ccc2c(c1)onc2O 1P00FHGN [0,1,0,1,0,0|1,0,0]=3 7320 B12R2.612 Clc1cc2COC(=O)c2cn1 1P00AB2T [0,1,0,1,0,0|2,0,0]=4 7321 B12R2.612 Clc1ccc2c(c1)C=CC2=O 1P02870X [0,1,0,1,0,0|2,0,0]=4 7322 B12R2.612 Clc1ccc2c(c1)CCC2=O 1P0034PD [0,1,0,1,0,0|2,0,0]=4 7323 B12R2.612 Clc1ccc2c(c1)CNC2=O 1P005WLJ [0,1,0,1,0,0|2,0,0]=4 7324 B12R2.612 Clc1ccc2c(c1)COC2=O 1P00DG7S [0,1,0,1,0,0|1,0,0]=3 7325 B12R2.612 Clc1ccc2c(c1)OCC2=O 1P003NN0 [0,1,0,1,0,0|1,0,0]=3 7326 B12R2.612 Clc1ccc2c(c1)OCC2O 1P01BFA9 [0,1,0,1,0,0|1,0,1]=4 7327 B12R2.612 Clc1ccc2c(c1)o[nH]c2=O 1P00EBPN [0,1,0,1,0,0|1,0,0]=3 7328 B12R2.612 Clc1ccc2c(c1)occ2Br 1P01B62K [0,1,0,1,0,0|2,0,0]=4 7329 B12R2.612 Clc1ccc2c(c1)onc2Cl 1P00ABVU [0,1,0,1,0,0|2,0,0]=4 7330 B12R2.612 Clc1ccc2c(c1)onc2N 1P003A7J [0,1,0,1,0,0|2,0,0]=4 7331 B12R2.612 Clc1ccc2c(c1)s[nH]c2=O 1P006CQX [0,1,0,1,0,0|1,1,0]=4 7332 B12R2.612 Clc1ccc2c(n1)COC2=O 1P027WEE [0,1,0,1,0,0|2,0,0]=4 7333 B12R2.612 Fc1ccc2c(c1)CCC2=O 1P003N7E [0,1,0,1,0,0|2,0,0]=4 7334 B12R2.612 Fc1ccc2c(c1)CNC2=O 1P000RGT [0,1,0,1,0,0|2,0,0]=4 7335 B12R2.612 Fc1ccc2c(c1)COC2=O 1P005GE9 [0,1,0,1,0,0|1,0,0]=3 7336 B12R2.612 Fc1ccc2c(c1)OCC2=O 1P003NOI [0,1,0,1,0,0|1,0,0]=3 7337 B12R2.612 Fc1ccc2c(c1)[nH][nH]c2=O 1P004T6D [0,1,0,1,0,0|2,0,0]=4 7338 B12R2.612 Fc1ccc2c(c1)[nH]nc2O 1P01JXLG [0,1,0,1,0,0|2,0,0]=4 7339 B12R2.612 Fc1ccc2c(c1)o[nH]c2=O 1P003WI5 [0,1,0,1,0,0|1,0,0]=3 7340 B12R2.612 Fc1ccc2c(c1)onc2Br 1P01C2ZK [0,1,0,1,0,0|2,0,0]=4 7341 B12R2.612 Fc1ccc2c(c1)onc2Cl 1P007A77 [0,1,0,1,0,0|2,0,0]=4 7342 B12R2.612 Fc1ccc2c(c1)onc2N 1P00265K [0,1,0,1,0,0|2,0,0]=4 7343 B12R2.612 Fc1ccc2c(c1)s[nH]c2=O 1P001RVG [0,1,0,1,0,0|1,1,0]=4 7344 B12R2.612 Ic1ccc2c(c1)C=NC2=O 1P0087BL [0,1,0,1,0,0|2,0,0]=4 7345 B12R2.612 Ic1ccc2c(c1)CCC2=O 1P00DA13 [0,1,0,1,0,0|2,0,0]=4 7346 B12R2.612 Nc1ccc2c(c1)CCC2=O 1P0036CK [0,1,0,1,0,0|2,0,0]=4 7347 B12R2.612 Nc1ccc2c(c1)CNC2=O 1P003MUW [0,1,0,1,0,0|2,0,0]=4 7348 B12R2.612 Nc1ccc2c(c1)COC2=O 1P00E9B4 [0,1,0,1,0,0|1,0,0]=3 7349 B12R2.612 Nc1ccc2c(c1)[nH][nH]c2=O 1P003NIR [0,1,0,1,0,0|2,0,0]=4 7350 B12R2.612 Nc1ccc2c(c1)[nH]nc2O 1P00E9QE [0,1,0,1,0,0|2,0,0]=4 7351 B12R2.612 Nc1ccc2c(c1)onc2C 1P01B5N2 [0,1,0,1,0,0|2,0,0]=4 7352 B12R2.612 Nc1cnc2c(c1)COC2=O 1P02858M [0,1,0,1,0,0|2,0,0]=4 7353 B12R2.612 Oc1ccc2c(c1)CCC2=O 1P003N8Y [0,1,0,1,0,0|2,0,0]=4 7354 B12R2.612 Oc1ccc2c(c1)CNC2=O 1P002RE7 [0,1,0,1,0,0|2,0,0]=4 7355 B12R2.612 Oc1ccc2c(c1)COC2=O 1P0037K6 [0,1,0,1,0,0|1,0,0]=3 7356 B12R2.612 Oc1ccc2c(c1)OCC2=O 1P003NP1 [0,1,0,1,0,0|1,0,0]=3 7357 B12R2.612 Oc1ccc2c(c1)OCC2O 1P019UKE [0,1,0,1,0,0|1,0,1]=4 7358 B12R2.612 Oc1ccc2c(c1)onc2C 1P00FDPE [0,1,0,1,0,0|2,0,0]=4 7359 B12R2.612 Oc1ccc2c(c1)onc2O 1P028O1J [0,1,0,1,0,0|1,0,0]=3 7360 B12R2.132 Brc1ccc2c(c1)C(=O)CC2 1P001DJO [0,1,0,1,0,0|2,0,0]=4 7361 B12R2.132 Brc1ccc2c(c1)C(=O)CO2 1P00D8HQ [0,1,0,1,0,0|1,0,0]=3 7362 B12R2.132 Brc1ccc2c(c1)C(=O)CS2 1P00AR9J [0,1,0,1,0,0|1,1,0]=4 7363 B12R2.132 Brc1ccc2c(c1)C(=O)NC2 1P003NKB [0,1,0,1,0,0|2,0,0]=4 7364 B12R2.132 Brc1ccc2c(c1)C(=O)OC2 1P007RXP [0,1,0,1,0,0|1,0,0]=3 7365 B12R2.132 Brc1ccc2c(c1)C(O)CO2 1P01A3HB [0,1,0,1,0,0|1,0,1]=4 7366 B12R2.132 Brc1ccc2c(c1)c(=O)[nH]o2 1P00FFS8 [0,1,0,1,0,0|1,0,0]=3 7367 B12R2.132 Brc1ccc2c(c1)c(=O)[nH]s2 1P00I2AJ [0,1,0,1,0,0|1,1,0]=4 7368 B12R2.132 Brc1ccc2c(c1)c(Br)co2 1P006O2H [0,1,0,1,0,0|2,0,0]=4 7369 B12R2.132 Brc1ccc2c(c1)c(C)co2 1P003MZ6 [0,1,0,1,0,0|2,0,0]=4 7370 B12R2.132 Brc1ccc2c(c1)c(C)no2 1P00FCDZ [0,1,0,1,0,0|2,0,0]=4 7371 B12R2.132 Brc1ccc2c(c1)c(Cl)no2 1P00CM34 [0,1,0,1,0,0|2,0,0]=4 7372 B12R2.132 Brc1ccc2c(c1)c(N)no2 1P00DIC3 [0,1,0,1,0,0|2,0,0]=4 7373 B12R2.132 Brc1ccc2c(c1)c(O)n[nH]2 1P0036OM [0,1,0,1,0,0|2,0,0]=4 7374 B12R2.132 Brc1cnc2c(c1)C(=O)CO2 1P00A63Y [0,1,0,1,0,0|2,0,0]=4 7375 B12R2.132 Cc1ccc2c(c1)C(=O)CC2 1P002PAD [0,1,0,1,0,0|2,0,0]=4 7376 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 1P00DJVX [0,1,0,1,0,0|1,0,0]=3 7377 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 1P00EKHK [0,1,0,1,0,0|2,0,0]=4 7378 B12R2.132 Cc1ccc2c(c1)C(=O)OC2 1P008RA0 [0,1,0,1,0,0|1,0,0]=3 7379 B12R2.132 Cc1ccc2c(c1)c(=O)[nH]o2 1P00FHWV [0,1,0,1,0,0|1,0,0]=3 7380 B12R2.132 Cc1ccc2c(c1)c(Br)co2 1P01C48R [0,1,0,1,0,0|2,0,0]=4 7381 B12R2.132 Cc1ccc2c(c1)c(N)no2 1P00IGDE [0,1,0,1,0,0|2,0,0]=4 7382 B12R2.132 Cc1ccc2c(c1)c(O)co2 1P019W95 [0,1,0,1,0,0|1,0,0]=3 7383 B12R2.132 Clc1ccc2c(c1)C(=O)CC2 1P001DJP [0,1,0,1,0,0|2,0,0]=4 7384 B12R2.132 Clc1ccc2c(c1)C(=O)CO2 1P00I6NU [0,1,0,1,0,0|1,0,0]=3 7385 B12R2.132 Clc1ccc2c(c1)C(=O)NC2 1P00EDEX [0,1,0,1,0,0|2,0,0]=4 7386 B12R2.132 Clc1ccc2c(c1)C(=O)OC2 1P00ADHJ [0,1,0,1,0,0|1,0,0]=3 7387 B12R2.132 Clc1ccc2c(c1)c(=O)[nH]o2 1P002P79 [0,1,0,1,0,0|1,0,0]=3 7388 B12R2.132 Clc1ccc2c(c1)c(=O)[nH]s2 1P00DFPH [0,1,0,1,0,0|1,1,0]=4 7389 B12R2.132 Clc1ccc2c(c1)c(C)no2 1P002XI9 [0,1,0,1,0,0|2,0,0]=4 7390 B12R2.132 Clc1ccc2c(c1)c(C)on2 1P00I8HX [0,1,0,1,0,0|2,0,0]=4 7391 B12R2.132 Clc1ccc2c(c1)c(Cl)no2 1P007XB6 [0,1,0,1,0,0|2,0,0]=4 7392 B12R2.132 Clc1ccc2c(c1)c(N)no2 1P005NSF [0,1,0,1,0,0|2,0,0]=4 7393 B12R2.132 Clc1ccc2c(n1)C(=O)OC2 1P01ELLA [0,1,0,1,0,0|2,0,0]=4 7394 B12R2.132 Fc1ccc2c(c1)C(=N)OC2 1P01EJ85 [0,1,0,1,0,0|2,0,0]=4 7395 B12R2.132 Fc1ccc2c(c1)C(=O)CC2 1P001FX5 [0,1,0,1,0,0|2,0,0]=4 7396 B12R2.132 Fc1ccc2c(c1)C(=O)CO2 1P00EBEB [0,1,0,1,0,0|1,0,0]=3 7397 B12R2.132 Fc1ccc2c(c1)C(=O)NC2 1P00CLFQ [0,1,0,1,0,0|2,0,0]=4 7398 B12R2.132 Fc1ccc2c(c1)C(=O)OC2 1P006Y88 [0,1,0,1,0,0|1,0,0]=3 7399 B12R2.132 Fc1ccc2c(c1)c(=O)[nH]o2 1P003WOB [0,1,0,1,0,0|1,0,0]=3 7400 B12R2.132 Fc1ccc2c(c1)c(=O)[nH]s2 1P020LGG [0,1,0,1,0,0|1,1,0]=4 7401 B12R2.132 Fc1ccc2c(c1)c(Br)co2 1P01C4AU [0,1,0,1,0,0|2,0,0]=4 7402 B12R2.132 Fc1ccc2c(c1)c(C)co2 1P00CLP1 [0,1,0,1,0,0|2,0,0]=4 7403 B12R2.132 Fc1ccc2c(c1)c(Cl)no2 1P0026R3 [0,1,0,1,0,0|2,0,0]=4 7404 B12R2.132 Fc1ccc2c(c1)c(N)no2 1P004RF5 [0,1,0,1,0,0|2,0,0]=4 7405 B12R2.132 Ic1ccc2c(c1)C(=O)CC2 1P001DJN [0,1,0,1,0,0|2,0,0]=4 7406 B12R2.132 Ic1ccc2c(c1)C(=O)N=C2 1P006GKC [0,1,0,1,0,0|2,0,0]=4 7407 B12R2.132 Ic1ccc2c(c1)C(=O)OC2 1P00DAZT [0,1,0,1,0,0|1,0,0]=3 7408 B12R2.132 Ic1ccc2c(c1)c(=O)[nH][nH]2 1P001GFE [0,1,0,1,0,0|2,0,0]=4 7409 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 1P005SO1 [0,1,0,1,0,0|2,0,0]=4 7410 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 1P027Y89 [0,1,0,1,0,0|2,0,0]=4 7411 B12R2.132 Nc1ccc2c(c1)C(=O)NC2 1P005NTX [0,1,0,1,0,0|2,0,0]=4 7412 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 1P0036P8 [0,1,0,1,0,0|1,0,0]=3 7413 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 1P00I1C6 [0,1,0,1,0,0|1,0,0]=3 7414 B12R2.132 Nc1ccc2c(c1)c(=O)[nH]o2 1P005DWQ [0,1,0,1,0,0|1,0,0]=3 7415 B12R2.132 Nc1ccc2c(c1)c(C)co2 1P01AFXN [0,1,0,1,0,0|2,0,0]=4 7416 B12R2.132 Nc1ccc2c(c1)c(C)no2 1P004WT4 [0,1,0,1,0,0|2,0,0]=4 7417 B12R2.132 Nc1ccc2c(c1)c(O)n[nH]2 1P0087BU [0,1,0,1,0,0|2,0,0]=4 7418 B12R2.132 Nc1ccc2c(c1)c(O)n[nH]2 1P00J385 [0,1,0,1,0,0|2,0,0]=4 7419 B12R2.132 Oc1ccc2c(c1)C(=O)CC2 1P003NP0 [0,1,0,1,0,0|2,0,0]=4 7420 B12R2.132 Oc1ccc2c(c1)C(=O)CO2 1P00ASRA [0,1,0,1,0,0|1,0,0]=3 7421 B12R2.132 Oc1ccc2c(c1)C(=O)N=C2 1P003NPE [0,1,0,1,0,0|2,0,0]=4 7422 B12R2.132 Oc1ccc2c(c1)C(=O)OC2 1P00DL67 [0,1,0,1,0,0|1,0,0]=3 7423 B12R2.1 BrCc1coc2c1cccc2 1P007B7C [0,1,0,1,0,0|2,0,0]=4 7424 B12R2.1 BrCc1noc2c1cccc2 1P0077Q4 [0,1,0,1,0,0|2,0,0]=4 7425 B12R2.1 BrCc1onc2c1cccc2 1P01C8JK [0,1,0,1,0,0|2,0,0]=4 7426 B12R2.1 C#Cc1coc2c1cccc2 1P028ZBJ [0,1,0,1,0,0|2,0,0]=4 7427 B12R2.1 COc1c[nH]c2c1cccc2 1P001XM3 [0,1,0,1,0,0|2,0,0]=4 7428 B12R2.1 N#Cc1coc2c1cccc2 1P00IMQ3 [0,1,0,1,0,0|2,0,0]=4 7429 B12R2.1 NCc1coc2c1cccc2 1P003IMY [0,1,0,1,0,0|2,0,0]=4 7430 B12R2.1 NCc1noc2c1cccc2 1P001O71 [0,1,0,1,0,0|2,0,0]=4 7431 B12R2.1 NCc1noc2c1cccc2 1P01BG8N [0,1,0,1,0,0|2,0,0]=4 7432 B12R2.1 O=Cc1c[nH]c2c1cccc2 1P0035HJ [0,1,0,1,0,0|2,0,0]=4 7433 B12R2.1 O=Cc1coc2c1cccc2 1P0034YL [0,1,0,1,0,0|1,0,0]=3 7434 B12R2.1 O=Cc1csc2c1cccc2 1P003352 [0,1,0,1,0,0|1,1,0]=4 7435 B12R2.1 O=Cc1n[nH]c2c1cccc2 1P0036FI [0,1,0,1,0,0|2,0,0]=4 7436 B12R2.1 O=Cc1noc2c1cccc2 1P004XMO [0,1,0,1,0,0|1,0,0]=3 7437 B12R2.1 O=Cc1nsc2c1cccc2 1P02931Z [0,1,0,1,0,0|1,1,0]=4 7438 B12R2.1 O=Cc1onc2c1cccc2 1P005URO [0,1,0,1,0,0|1,0,0]=3 7439 B12R2.1 O=Cc1snc2c1cccc2 1P028N1E [0,1,0,1,0,0|1,1,0]=4 7440 B12R2.1 OCc1c[nH]c2c1cccc2 1P003RGV [0,1,0,1,0,0|2,0,0]=4 7441 B12R2.1 OCc1csc2c1cccc2 1P00D8OP [0,1,0,1,0,0|1,1,0]=4 7442 B12R2.1 OCc1n[nH]c2c1cccc2 1P00EDBK [0,1,0,1,0,0|2,0,0]=4 7443 B12R2.1 OCc1noc2c1cccc2 1P00236A [0,1,0,1,0,0|1,0,0]=3 7444 B12R2.1 O\N=C/1\CCc2c1cccc2 1P003EVX [0,1,0,1,0,0|2,0,0]=4 7445 B12R2.18 Brc1c(C)oc2c1cccc2 1P00EPBB [0,1,0,1,0,0|2,0,0]=4 7446 B12R2.18 Cc1c(C)oc2c1cccc2 1P00BYVJ [0,1,0,1,0,0|2,0,0]=4 7447 B12R2.18 Cn1[nH]c2c(c1=O)cccc2 1P00ARH1 [0,1,0,1,0,0|2,0,0]=4 7448 B12R2.18 Cn1c(=O)oc2c1cccc2 1P003K5Q [0,1,0,1,0,0|2,0,0]=4 7449 B12R2.18 Cn1sc2c(c1=O)cccc2 1P003AYB [0,1,0,1,0,0|1,1,0]=4 7450 B12R2.18 O=C1C(=O)Cc2c1cccc2 1P001T94 [0,1,0,1,0,0|1,0,1]=4 7451 B12R2.18 O=C1C(=O)Nc2c1cccc2 1P003RIR [0,1,0,1,0,0|1,0,1]=4 7452 B12R2.18 O=C1C(=O)Oc2c1cccc2 1P003OIQ [0,1,0,1,0,0|0,0,1]=3 7453 B12R2.18 O=C1C(=O)Sc2c1cccc2 1P00714N [0,1,0,1,0,0|0,1,1]=4 7454 B12R2.18 O=C1C(Br)Cc2c1cccc2 1P0025TP [0,1,0,1,0,0|2,0,0]=4 7455 B12R2.18 O=C1C(C)Cc2c1cccc2 1P0020JO [0,1,0,1,0,0|2,0,0]=4 7456 B12R2.18 O=C1C(Cl)Cc2c1cccc2 1P00B2LH [0,1,0,1,0,0|2,0,0]=4 7457 B12R2.18 O=C1C(F)Cc2c1cccc2 1P00FGGF [0,1,0,1,0,0|2,0,0]=4 7458 B12R2.18 O=C1C(N)Cc2c1cccc2 1P00FJCX [0,1,0,1,0,0|2,0,0]=4 7459 B12R2.18 O=C1N(N)Cc2c1cccc2 1P01A66S [0,1,0,1,0,0|2,0,0]=4 7460 B12R2.18 O=C1Nc2c(C1O)cccc2 1P00EZKX [0,1,0,1,0,0|1,0,1]=4 7461 B12R2.18 O=c1oc2c(c1C)ccoc2 1P004Q5T [0,1,0,1,0,0|2,0,0]=4 7462 B12R2.18 On1c(=O)[nH]c2c1cccc2 1P00DX1I [0,1,0,1,0,0|2,0,0]=4 7463 B8R1.7 CC(=C1C=CC=C1)O 1P006CQI [1,0,0,0,1,0|1,0,0]=3 7464 B8R1.7 CC(=O)[C-]1C=CC=C1 1P000X4S [1,0,0,0,1,0|1,0,1]=4 7465 B8R1.7 CC(=O)[C-]1C=CC=C1 1P000XD8 [1,0,0,0,1,0|1,0,1]=4 7466 B8R1.7 CC(=O)c1c[nH]cc1 1P0039FK [1,0,0,0,1,0|2,0,0]=4 7467 B8R1.7 CC(=O)c1ccc[nH]1 1P003GRE [1,0,0,0,1,0|2,0,0]=4 7468 B8R1.7 CC(=O)c1ccco1 1P000IT2 [1,0,0,0,1,0|2,0,0]=4 7469 B8R1.7 CC(=O)c1cccs1 1P0035MZ [1,0,0,0,1,0|2,0,0]=4 7470 B8R1.7 CC(=O)c1cocc1 1P009E7F [1,0,0,0,1,0|2,0,0]=4 7471 B8R1.7 CC(=O)c1cscc1 1P001ETA [1,0,0,0,1,0|2,0,0]=4 7472 B8R1.7 ClC(=O)c1ccc[nH]1 1P01I097 [1,0,0,0,1,0|2,0,0]=4 7473 B8R1.7 ClC(=O)c1cccs1 1P003BQI [1,0,0,0,1,0|2,0,0]=4 7474 B8R1.7 ClC(=O)c1cocc1 1P002SR8 [1,0,0,0,1,0|2,0,0]=4 7475 B8R1.7 ClC(=O)c1cscc1 1P00IL11 [1,0,0,0,1,0|2,0,0]=4 7476 B8R1.7 NC(=O)c1ccc[nH]1 1P00DASS [1,0,0,0,1,0|2,0,0]=4 7477 B8R1.7 NC(=O)c1ccco1 1P003HT3 [1,0,0,0,1,0|2,0,0]=4 7478 B8R1.7 NC(=O)c1cocc1 1P00EFS9 [1,0,0,0,1,0|2,0,0]=4 7479 B8R1.7 NC(=O)c1cscc1 1P003V9E [1,0,0,0,1,0|2,0,0]=4 7480 B8R1.7 OC(=O)[C-]1C=CC=C1 1P000X4X [1,0,0,0,1,0|0,0,1]=3 7481 B8R1.7 OC(=O)[C-]1C=CC=C1 1P000ZJ9 [1,0,0,0,1,0|0,0,1]=3 7482 B8R1.7 OC(=O)c1c[nH]cc1 1P003UJU [1,0,0,0,1,0|1,0,0]=3 7483 B8R1.7 OC(=O)c1c[nH]cn1 1P00338I [1,0,0,0,1,0|2,0,0]=4 7484 B8R1.7 OC(=O)c1c[nH]nc1 1P0034LR [1,0,0,0,1,0|2,0,0]=4 7485 B8R1.7 OC(=O)c1cc[nH]n1 1P001T7R [1,0,0,0,1,0|2,0,0]=4 7486 B8R1.7 OC(=O)c1ccc[nH]1 1P00360N [1,0,0,0,1,0|1,0,0]=3 7487 B8R1.7 OC(=O)c1cccs1 1P003IEW [1,0,0,0,1,0|1,0,0]=3 7488 B8R1.7 OC(=O)c1ccn[nH]1 1P008M23 [1,0,0,0,1,0|2,0,0]=4 7489 B8R1.7 OC(=O)c1ccno1 1P003RMK [1,0,0,0,1,0|2,0,0]=4 7490 B8R1.7 OC(=O)c1ccns1 1P0008NL [1,0,0,0,1,0|2,0,0]=4 7491 B8R1.7 OC(=O)c1ccon1 1P0038IR [1,0,0,0,1,0|2,0,0]=4 7492 B8R1.7 OC(=O)c1ccsn1 1P006Z9D [1,0,0,0,1,0|2,0,0]=4 7493 B8R1.7 OC(=O)c1cnco1 1P0038RZ [1,0,0,0,1,0|2,0,0]=4 7494 B8R1.7 OC(=O)c1cncs1 1P001L77 [1,0,0,0,1,0|2,0,0]=4 7495 B8R1.7 OC(=O)c1cocc1 1P00346H [1,0,0,0,1,0|1,0,0]=3 7496 B8R1.7 OC(=O)c1cocn1 1P002MBN [1,0,0,0,1,0|2,0,0]=4 7497 B8R1.7 OC(=O)c1conc1 1P00EAGN [1,0,0,0,1,0|2,0,0]=4 7498 B8R1.7 OC(=O)c1cscc1 1P00348Y [1,0,0,0,1,0|1,0,0]=3 7499 B8R1.7 OC(=O)c1cscn1 1P003MJ5 [1,0,0,0,1,0|2,0,0]=4 7500 B8R1.7 OC(=O)c1csnc1 1P0050GK [1,0,0,0,1,0|2,0,0]=4 7501 B8R1.7 OC(=O)c1ncc[nH]1 1P00338H [1,0,0,0,1,0|2,0,0]=4 7502 B8R1.7 OC(=O)c1ncco1 1P0035WL [1,0,0,0,1,0|2,0,0]=4 7503 B8R1.7 OC(=O)c1ncco1 1P028A5I [1,0,0,0,1,0|2,0,0]=4 7504 B8R1.7 OC(=O)c1nccs1 1P001HT7 [1,0,0,0,1,0|2,0,0]=4 7505 B8R1.7 [O-]C(=O)c1cccs1 1P002R08 [1,0,0,0,1,0|1,0,1]=4 7506 B8R1.7 [O-]C(=O)c1cccs1 1P00353G [1,0,0,0,1,0|1,0,1]=4 7507 B8R1.7 [O-]C(=O)c1cccs1 1P01XCZI [1,0,0,0,1,0|1,0,1]=4 7508 B8R1.11 Brc1c(C=O)cc[nH]1 1P0293SK [1,0,0,0,1,0|2,0,0]=4 7509 B8R1.11 Brc1c[nH]cc1C=O 1P01DWFP [1,0,0,0,1,0|2,0,0]=4 7510 B8R1.11 Brc1cocc1C=O 1P021PTN [1,0,0,0,1,0|2,0,0]=4 7511 B8R1.11 Brc1cscc1C=O 1P002H1I [1,0,0,0,1,0|2,0,0]=4 7512 B8R1.11 Brc1occc1C=O 1P007P64 [1,0,0,0,1,0|2,0,0]=4 7513 B8R1.11 Brc1sccc1C=O 1P0038OD [1,0,0,0,1,0|2,0,0]=4 7514 B8R1.11 Cc1cocc1C=O 1P0289XQ [1,0,0,0,1,0|2,0,0]=4 7515 B8R1.11 Cc1cscc1C=O 1P00G8DI [1,0,0,0,1,0|2,0,0]=4 7516 B8R1.11 Cc1occc1C=O 1P00DBXY [1,0,0,0,1,0|2,0,0]=4 7517 B8R1.11 Cc1sccc1C=O 1P004NVR [1,0,0,0,1,0|2,0,0]=4 7518 B8R1.11 Clc1cscc1C=O 1P01A1WN [1,0,0,0,1,0|2,0,0]=4 7519 B8R1.11 Clc1sccc1C=O 1P009WTJ [1,0,0,0,1,0|2,0,0]=4 7520 B8R1.11 Ic1sccc1C=O 1P002H71 [1,0,0,0,1,0|2,0,0]=4 7521 B8R1.11 O=Cc1[nH]ccc1Br 1P00CRE5 [1,0,0,0,1,0|2,0,0]=4 7522 B8R1.11 O=Cc1[nH]ccc1C 1P007OR5 [1,0,0,0,1,0|2,0,0]=4 7523 B8R1.11 O=Cc1cccn1C 1P000IT4 [1,0,0,0,1,0|2,0,0]=4 7524 B8R1.11 O=Cc1occc1Br 1P006VJD [1,0,0,0,1,0|2,0,0]=4 7525 B8R1.11 O=Cc1occc1F 1P01DTUB [1,0,0,0,1,0|2,0,0]=4 7526 B8R1.11 O=Cc1sccc1Br 1P003JM1 [1,0,0,0,1,0|2,0,0]=4 7527 B8R1.11 O=Cc1sccc1C 1P00347R [1,0,0,0,1,0|2,0,0]=4 7528 B8R1.11 O=Cc1sccc1Cl 1P0061KR [1,0,0,0,1,0|2,0,0]=4 7529 B8R1.11 O=Cc1sccc1I 1P01H392 [1,0,0,0,1,0|2,0,0]=4 7530 B8R1.11 O=Cc1sccc1N 1P00EIWP [1,0,0,0,1,0|2,0,0]=4 7531 B12R1.125 CC(=O)CCc1ccccc1Cl 1P01HUV1 [0,0,0,0,0,2|2,0,0]=4 7532 B12R1.125 CC(=O)CCc1ccccc1F 1P01AIYU [0,0,0,0,0,2|2,0,0]=4 7533 B12R1.125 CC(=O)NCc1ccccc1Br 1P008QXJ [0,0,0,0,0,2|2,0,0]=4 7534 B12R1.125 CC(=O)NCc1ccccc1Cl 1P00EMME [0,0,0,0,0,2|2,0,0]=4 7535 B12R1.125 CC(=O)NCc1ccccc1N 1P028LKH [0,0,0,0,0,2|2,0,0]=4 7536 B12R1.125 CC(=O)NCc1ccccc1O 1P008NEH [0,0,0,0,0,2|1,0,0]=3 7537 B12R1.125 CC(=O)NNc1ccccc1F 1P01EKID [0,0,0,0,0,2|2,0,0]=4 7538 B12R1.125 C[C@H](COc1ccccc1O)O 1P027W1Q [0,0,0,0,0,2|1,0,1]=4 7539 B12R1.125 Cc1ccncc1C=CC(=O)O 1P01A70S [0,0,0,0,0,2|2,0,0]=4 7540 B12R1.125 Cc1ccncc1CCC(=O)O 1P000ZN8 [0,0,0,0,0,2|2,0,0]=4 7541 B12R1.125 Cc1ncccc1C=CC(=O)O 1P01AV9J [0,0,0,0,0,2|2,0,0]=4 7542 B12R1.125 Cc1ncccc1CCC(=O)O 1P00ICJI [0,0,0,0,0,2|2,0,0]=4 7543 B12R1.125 Cc1ncccc1CCC(=O)O 1P0281ED [0,0,0,0,0,2|2,0,0]=4 7544 B12R1.125 ClC(=O)C=Cc1ccccc1Cl 1P003HIP [0,0,0,0,0,2|2,0,0]=4 7545 B12R1.125 ClC(=O)CCc1ccccc1Br 1P01EZGG [0,0,0,0,0,2|2,0,0]=4 7546 B12R1.125 ClC(=O)OCc1ccccc1Cl 1P003HIJ [0,0,0,0,0,2|2,0,0]=4 7547 B12R1.125 ClC(=O)OCc1ccccc1F 1P01B3WB [0,0,0,0,0,2|2,0,0]=4 7548 B12R1.125 ClC(=O)\C=C\c1ccccc1Br 1P00JD7K [0,0,0,0,0,2|2,0,0]=4 7549 B12R1.125 NC(=O)CCc1ccccc1N 1P01BVV9 [0,0,0,0,0,2|2,0,0]=4 7550 B12R1.125 NC(=O)CCc1ccccc1O 1P007P5E [0,0,0,0,0,2|1,0,0]=3 7551 B12R1.125 NC(=O)CNc1ccccc1Br 1P027XV8 [0,0,0,0,0,2|2,0,0]=4 7552 B12R1.125 NC(=O)COc1ccccc1C 1P00BXOH [0,0,0,0,0,2|2,0,0]=4 7553 B12R1.125 NC(=O)COc1ccccc1Cl 1P003F81 [0,0,0,0,0,2|2,0,0]=4 7554 B12R1.125 NC(=O)COc1ccccc1O 1P00C69V [0,0,0,0,0,2|1,0,0]=3 7555 B12R1.125 NC(=O)CSc1ccccc1N 1P019OTG [0,0,0,0,0,2|2,0,0]=4 7556 B12R1.125 NC(=O)NCc1ccccc1Cl 1P00ISCK [0,0,0,0,0,2|2,0,0]=4 7557 B12R1.125 NC(=O)NCc1ccccc1F 1P01AB49 [0,0,0,0,0,2|2,0,0]=4 7558 B12R1.125 NC(=O)\C=C\c1ccccc1F 1P01EY2F [0,0,0,0,0,2|2,0,0]=4 7559 B12R1.125 OC(=O)C#Cc1ccccc1C 1P00JTBO [0,0,0,0,0,2|1,0,0]=3 7560 B12R1.125 OC(=O)C#Cc1ccccc1Cl 1P00JTBJ [0,0,0,0,0,2|1,0,0]=3 7561 B12R1.125 OC(=O)C#Cc1ccccc1F 1P00FEGZ [0,0,0,0,0,2|1,0,0]=3 7562 B12R1.125 OC(=O)C=Cc1ccccc1Br 1P0033MW [0,0,0,0,0,2|1,0,0]=3 7563 B12R1.125 OC(=O)C=Cc1ccccc1C 1P019O2E [0,0,0,0,0,2|1,0,0]=3 7564 B12R1.125 OC(=O)C=Cc1ccccc1Cl 1P0033PW [0,0,0,0,0,2|1,0,0]=3 7565 B12R1.125 OC(=O)C=Cc1ccccc1F 1P003HSF [0,0,0,0,0,2|1,0,0]=3 7566 B12R1.125 OC(=O)C=Cc1ncccc1C 1P01A6KK [0,0,0,0,0,2|2,0,0]=4 7567 B12R1.125 OC(=O)C=Cc1ncccc1C 1P01AC40 [0,0,0,0,0,2|2,0,0]=4 7568 B12R1.125 OC(=O)CCc1ccccc1Br 1P001NLG [0,0,0,0,0,2|1,0,0]=3 7569 B12R1.125 OC(=O)CCc1ccccc1C 1P003BQQ [0,0,0,0,0,2|1,0,0]=3 7570 B12R1.125 OC(=O)CCc1ccccc1Cl 1P001V8E [0,0,0,0,0,2|1,0,0]=3 7571 B12R1.125 OC(=O)CCc1ccccc1F 1P001V8F [0,0,0,0,0,2|1,0,0]=3 7572 B12R1.125 OC(=O)CCc1ccccc1I 1P00IKAW [0,0,0,0,0,2|1,0,0]=3 7573 B12R1.125 OC(=O)CCc1ccccc1O 1P003IHI [0,0,0,0,0,2|0,0,0]=2 7574 B12R1.125 OC(=O)CCc1cccnc1Cl 1P01B612 [0,0,0,0,0,2|2,0,0]=4 7575 B12R1.125 OC(=O)CCc1cccnc1F 1P00IIRH [0,0,0,0,0,2|2,0,0]=4 7576 B12R1.125 OC(=O)CCc1ccncc1C 1P00HBM0 [0,0,0,0,0,2|2,0,0]=4 7577 B12R1.125 OC(=O)CCc1ccncc1F 1P0201YO [0,0,0,0,0,2|2,0,0]=4 7578 B12R1.125 OC(=O)CCc1cncnc1O 1P01CAP4 [0,0,0,0,0,2|2,0,0]=4 7579 B12R1.125 OC(=O)CCc1ncccc1C 1P00ICJG [0,0,0,0,0,2|2,0,0]=4 7580 B12R1.125 OC(=O)CCn1ccccc1=O 1P00FFU4 [0,0,0,0,0,2|1,0,1]=4 7581 B12R1.125 OC(=O)CNc1ccccc1Cl 1P00FHKA [0,0,0,0,0,2|1,0,0]=3 7582 B12R1.125 OC(=O)CNc1ccccc1F 1P00D9L6 [0,0,0,0,0,2|1,0,0]=3 7583 B12R1.125 OC(=O)COc1ccccc1Br 1P002H0V [0,0,0,0,0,2|1,0,0]=3 7584 B12R1.125 OC(=O)COc1ccccc1C 1P002GYV [0,0,0,0,0,2|1,0,0]=3 7585 B12R1.125 OC(=O)COc1ccccc1F 1P003C3Z [0,0,0,0,0,2|1,0,0]=3 7586 B12R1.125 OC(=O)COc1ccccc1O 1P003HWK [0,0,0,0,0,2|0,0,0]=2 7587 B12R1.125 OC(=O)COc1cccnc1Cl 1P0290SA [0,0,0,0,0,2|2,0,0]=4 7588 B12R1.125 OC(=O)CSc1cccc[n+]1[O-] 1P0057C6 [0,0,0,0,0,2|1,0,1]=4 7589 B12R1.125 OC(=O)CSc1ccccc1Br 1P01DUSN [0,0,0,0,0,2|1,0,0]=3 7590 B12R1.125 OC(=O)CSc1ccccc1C 1P00ADC0 [0,0,0,0,0,2|1,0,0]=3 7591 B12R1.125 OC(=O)CSc1ccccc1Cl 1P00ALGW [0,0,0,0,0,2|1,0,0]=3 7592 B12R1.125 OC(=O)CSc1ccccc1F 1P005UWQ [0,0,0,0,0,2|1,0,0]=3 7593 B12R1.125 OC(=O)CSc1ccccc1O 1P00536S [0,0,0,0,0,2|0,0,0]=2 7594 B12R1.125 OC(=O)\C=C\c1ccccc1Br 1P008OSG [0,0,0,0,0,2|1,0,0]=3 7595 B12R1.125 OC(=O)\C=C\c1ccccc1C 1P003I5R [0,0,0,0,0,2|1,0,0]=3 7596 B12R1.125 OC(=O)\C=C\c1ccccc1Cl 1P006B5H [0,0,0,0,0,2|1,0,0]=3 7597 B12R1.125 OC(=O)\C=C\c1ccccc1F 1P002E51 [0,0,0,0,0,2|1,0,0]=3 7598 B12R1.125 OC(=O)\C=C\c1ccccc1O 1P00IBBN [0,0,0,0,0,2|0,0,0]=2 7599 B12R1.125 OC(=O)\C=C\c1cccnc1F 1P0290X9 [0,0,0,0,0,2|2,0,0]=4 7600 B12R1.125 OC(=O)\C=C\c1ccncc1C 1P0289UN [0,0,0,0,0,2|2,0,0]=4 7601 B12R1.125 [O-]C(=O)CCc1ccccc1N 1P01JMCU [0,0,0,0,0,2|1,0,1]=4