0 B10R1.66 CC(=O)/C=C/C1=CC=CO1 MCULE-7175927536 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.66 CC(=O)/C=C/C1=CC=CS1 MCULE-9668699729 [0,0,0,0,0,0|0,1,0]=1 2 B10R1.66 CC(=O)/C=C/C1=CSC=C1 MCULE-9067564306 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.66 CC(=O)C=CC1=CC=CO1 MCULE-9905851815 [0,0,0,0,0,0|0,0,0]=0 4 B10R1.66 CC(=O)C=CC1=CC=CS1 MCULE-4792487998 [0,0,0,0,0,0|0,1,0]=1 5 B10R1.66 CC(=O)C=CC1=CSC=C1 MCULE-4852101760 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.66 CC(=O)CCC1=CC=CO1 MCULE-2101099047 [0,0,0,0,0,0|0,0,2]=2 7 B10R1.66 CC(=O)CCC1=CSC=C1 MCULE-1818012086 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.66 CC(=O)CCC1=NC=CS1 MCULE-2524666506 [0,0,0,0,0,0|1,1,2]=4 9 B10R1.66 CC(=O)CCN1C=CC=N1 MCULE-7966519689 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.66 CC(=O)CSC1=CC=CS1 MCULE-1447269840 [0,0,0,0,0,0|1,1,1]=3 11 B10R1.66 CC(=O)NCC1=CC=CO1 MCULE-3515662037 [0,0,0,0,0,0|1,0,1]=2 12 B10R1.66 CC(=O)NCC1=CC=CS1 MCULE-9977095360 [0,0,0,0,0,0|1,1,1]=3 13 B10R1.66 CC(=O)NCC1=NC=CN1 MCULE-2002294602 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.66 CC(=O)OC=C1C=CC=C1 MCULE-9595415944 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.66 CC(=O)OCC1=CC=CO1 MCULE-8997160416 [0,0,0,0,0,0|1,0,1]=2 16 B10R1.66 CC(=O)SCC1=CC=CO1 MCULE-2013313658 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.66 CC(=S)OCC1=CC=CO1 MCULE-2183015390 [0,0,0,0,0,0|1,1,1]=3 18 B10R1.66 CC(C)NCC1=CC=CO1 MCULE-4621751494 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.66 CC(C)NCC1=CC=CO1 MCULE-7799547841 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.66 CC(C)SCC1=CC=CO1 MCULE-4070824510 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.66 CC(N)CCC1=CC=CO1 MCULE-6992838263 [0,0,0,0,0,0|1,0,3]=4 22 B10R1.66 CN(C)/N=C/C1=CC=CO1 MCULE-9853274822 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.66 CN(C)N=CC1=CC=CO1 MCULE-7082620550 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.66 N=C(N)CCC1=CC=CO1 MCULE-4674401212 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.66 N=C(N)CCC1=CC=CO1 MCULE-8321587302 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.66 N=C(N)N=CC1=CC=CS1 MCULE-8205972371 [0,0,0,0,0,0|3,1,0]=4 27 B10R1.66 N=C(N)NCC1=CC=CO1 MCULE-1941139641 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.66 N=C(N)NCC1=CC=CO1 MCULE-9950183827 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.66 NC(=O)/C=C/C1=CC=CS1 MCULE-2550089532 [0,0,0,0,0,0|1,1,0]=2 30 B10R1.66 NC(=O)C=CC1=CC=CO1 MCULE-3308563945 [0,0,0,0,0,0|1,0,0]=1 31 B10R1.66 NC(=O)C=CC1=CC=CS1 MCULE-4715280412 [0,0,0,0,0,0|1,1,0]=2 32 B10R1.66 NC(=O)C=CC1=NC=CN1 MCULE-8278909510 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.66 NC(=O)NCC1=CC=CO1 MCULE-8058725801 [0,0,0,0,0,0|2,0,1]=3 34 B10R1.66 NC(=O)NCC1=CC=CS1 MCULE-1971855222 [0,0,0,0,0,0|2,1,1]=4 35 B10R1.66 NC(=S)NCC1=CC=CO1 MCULE-3624712939 [0,0,0,0,0,0|2,1,1]=4 36 B10R1.66 O=C(Cl)/C=C/C1=CC=CO1 MCULE-3961989188 [0,0,0,0,0,0|1,0,0]=1 37 B10R1.66 O=C(Cl)/C=C/C1=CC=CS1 MCULE-4325709525 [0,0,0,0,0,0|1,1,0]=2 38 B10R1.66 O=C(Cl)/C=C/C1=CSC=C1 MCULE-6636902806 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.66 O=C(Cl)C=CC1=CC=CO1 MCULE-9192017514 [0,0,0,0,0,0|1,0,0]=1 40 B10R1.66 O=C(Cl)C=CC1=CC=CS1 MCULE-4244086123 [0,0,0,0,0,0|1,1,0]=2 41 B10R1.66 O=C(Cl)C=CC1=COC=C1 MCULE-1866567105 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.66 O=C(Cl)CCC1=CC=CS1 MCULE-7371256050 [0,0,0,0,0,0|1,1,2]=4 43 B10R1.66 O=C(O)/C=C/C1=CC=CO1 MCULE-1000282553 [0,0,0,0,0,0|1,0,0]=1 44 B10R1.66 O=C(O)/C=C/C1=CC=CS1 MCULE-7724588931 [0,0,0,0,0,0|1,1,0]=2 45 B10R1.66 O=C(O)/C=C/C1=CN=CS1 MCULE-7572472922 [0,0,0,0,0,0|2,1,0]=3 46 B10R1.66 O=C(O)/C=C/C1=CNC=N1 MCULE-6953426192 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.66 O=C(O)/C=C/C1=COC=C1 MCULE-6642700286 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.66 O=C(O)/C=C/C1=CSC=C1 MCULE-1958527580 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.66 O=C(O)/C=C/C1=CSC=N1 MCULE-4774407164 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.66 O=C(O)/C=C/C1=NC=CN1 MCULE-6558776329 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.66 O=C(O)/C=C/C1=NC=CS1 MCULE-7172278941 [0,0,0,0,0,0|2,1,0]=3 52 B10R1.66 O=C(O)/C=C\C1=CN=CN1 MCULE-7236014213 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.66 O=C(O)C#CC1=CC=CO1 MCULE-9618528259 [0,0,0,0,0,0|1,0,2]=3 54 B10R1.66 O=C(O)C#CC1=CC=CS1 MCULE-6435823452 [0,0,0,0,0,0|1,1,2]=4 55 B10R1.66 O=C(O)C=CC1=CC=CN1 MCULE-5460570885 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.66 O=C(O)C=CC1=CC=CO1 MCULE-8349779970 [0,0,0,0,0,0|1,0,0]=1 57 B10R1.66 O=C(O)C=CC1=CC=CS1 MCULE-8401835373 [0,0,0,0,0,0|1,1,0]=2 58 B10R1.66 O=C(O)C=CC1=CN=CS1 MCULE-7641560153 [0,0,0,0,0,0|2,1,0]=3 59 B10R1.66 O=C(O)C=CC1=CNC=C1 MCULE-6780323683 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.66 O=C(O)C=CC1=CNC=N1 MCULE-7002606160 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.66 O=C(O)C=CC1=CNN=C1 MCULE-7650068377 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.66 O=C(O)C=CC1=COC=C1 MCULE-6318317369 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.66 O=C(O)C=CC1=COC=N1 MCULE-6369646194 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.66 O=C(O)C=CC1=CSC=C1 MCULE-3580115373 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.66 O=C(O)C=CC1=CSC=N1 MCULE-9549510844 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.66 O=C(O)C=CC1=NC=CN1 MCULE-8884945425 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.66 O=C(O)C=CC1=NC=CN1 MCULE-9780106777 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.66 O=C(O)C=CC1=NC=CS1 MCULE-2894674051 [0,0,0,0,0,0|2,1,0]=3 69 B10R1.66 O=C(O)CCC1=CC=CN1 MCULE-8495580718 [0,0,0,0,0,0|2,0,2]=4 70 B10R1.66 O=C(O)CCC1=CC=CO1 MCULE-3535606082 [0,0,0,0,0,0|1,0,2]=3 71 B10R1.66 O=C(O)CCC1=CC=CS1 MCULE-3548538547 [0,0,0,0,0,0|1,1,2]=4 72 B10R1.66 O=C(O)CCC1=CC=NO1 MCULE-2698728972 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.66 O=C(O)CCC1=NC=CO1 MCULE-8621379865 [0,0,0,0,0,0|2,0,2]=4 74 B10R1.66 O=C(O)CSC1=CC=CS1 MCULE-4950567579 [0,0,0,0,0,0|2,1,1]=4 75 B10R1.66 O=N(=O)/C=C/C1=CC=CO1 MCULE-3251448880 [0,0,0,0,0,0|2,0,0]=2 76 B10R1.66 O=N(=O)/C=C/C1=CC=CS1 MCULE-7150832797 [0,0,0,0,0,0|2,1,0]=3 77 B10R1.66 O=N(=O)/C=C/C1=CSC=C1 MCULE-5909409695 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.66 O=N(=O)/C=C/C1=NC=CS1 MCULE-7114943275 [0,0,0,0,0,0|3,1,0]=4 79 B10R1.66 O=N(=O)/C=C\C1=CC=CS1 MCULE-2612236247 [0,0,0,0,0,0|2,1,0]=3 80 B10R1.66 O=N(=O)CCC1=CC=CO1 MCULE-6179704930 [0,0,0,0,0,0|2,0,2]=4 81 B10R1.66 O=P([O-])CCC1=CC=CO1 MCULE-6900012549 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.66 O=P([O-])CCC1=CC=CO1 MCULE-7798677915 [0,0,0,0,0,0|2,0,2]=4 83 B10R1.66 O=[N+]([O-])C=CC1=CC=CO1 MCULE-8162497904 [0,0,0,0,0,0|2,0,0]=2 84 B10R1.66 O=[N+]([O-])C=CC1=CC=CS1 MCULE-6221010639 [0,0,0,0,0,0|2,1,0]=3 85 B10R1.66 O=[N+]([O-])C=CC1=COC=C1 MCULE-3859026504 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.66 O=[N+]([O-])C=CC1=CSC=C1 MCULE-4451456236 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.66 O=[N+]([O-])C=CC1=NC=CS1 MCULE-4223961275 [0,0,0,0,0,0|3,1,0]=4 88 B10R1.66 S=C(S)NCC1=CC=CO1 MCULE-7461708117 [0,0,0,0,0,0|2,1,1]=4 89 B10R1.66 [NH2+]=C(N)NCC1=CC=CO1 MCULE-3349084765 [0,0,0,0,0,0|3,0,1]=4 90 B9R1.12 CCCCC1=CC=CO1 MCULE-3071851671 [1,0,0,0,0,0|0,0,3]=4 91 B9R1.12 CCNCC1=CC=CO1 MCULE-7506170762 [1,0,0,0,0,0|1,0,2]=4 92 B9R1.12 CCNCC1=CC=CO1 MCULE-8195982909 [1,0,0,0,0,0|1,0,2]=4 93 B9R1.12 CCOCC1=CC=CO1 MCULE-8494437339 [1,0,0,0,0,0|1,0,2]=4 94 B9R1.12 CSSCC1=CC=CO1 MCULE-1102467891 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.12 N#CC=CC1=CC=CO1 MCULE-4729430851 [1,0,0,0,0,0|1,0,1]=3 96 B9R1.12 N#CC=CC1=CC=CS1 MCULE-8890229490 [1,0,0,0,0,0|1,1,1]=4 97 B9R1.12 NCC=CC1=CC=CS1 MCULE-7407262935 [1,0,0,0,0,0|1,1,1]=4 98 B9R1.12 O=C/C=C/C1=CC=CO1 MCULE-8071861971 [1,0,0,0,0,0|0,0,0]=1 99 B9R1.12 O=C/C=C/C1=COC=C1 MCULE-8756130782 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.12 O=C=NCC1=CC=CO1 MCULE-4576932798 [1,0,0,0,0,0|1,0,2]=4 101 B9R1.12 O=CC=CC1=CC=CN1 MCULE-2469885992 [1,0,0,0,0,0|1,0,0]=2 102 B9R1.12 O=CC=CC1=CC=CO1 MCULE-1727102658 [1,0,0,0,0,0|0,0,0]=1 103 B9R1.12 O=CNCC1=CC=CO1 MCULE-1492066833 [1,0,0,0,0,0|1,0,1]=3 104 B9R1.12 OCC=CC1=CC=CS1 MCULE-7126809926 [1,0,0,0,0,0|0,1,2]=4 105 B11R1.25 C=CC(=O)NCC1=CC=CO1 MCULE-5561657367 [0,1,0,0,0,0|1,0,2]=4 106 B11R1.25 CCC(=O)NCC1=CC=CO1 MCULE-2079627857 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.25 CCC(=O)NCC1=CC=CS1 MCULE-1610876111 [0,1,0,0,0,0|1,1,1]=4 108 B11R1.25 CCC(=O)OCC1=CC=CO1 MCULE-9103529082 [0,1,0,0,0,0|1,0,1]=3 109 B11R1.25 CCC(=O)SCC1=CC=CO1 MCULE-3385976920 [0,1,0,0,0,0|1,0,1]=3 110 B11R1.25 CCC(=S)OCC1=CC=CO1 MCULE-1045130761 [0,1,0,0,0,0|1,1,1]=4 111 B11R1.25 CNC(=O)NCC1=CC=CS1 MCULE-1125755388 [0,1,0,0,0,0|1,1,1]=4 112 B11R1.25 CNC(=S)NCC1=CC=CO1 MCULE-7571062094 [0,1,0,0,0,0|1,1,1]=4 113 B11R1.25 COC(=O)/C=C/C1=CC=CN1 MCULE-7480502311 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.25 COC(=O)/C=C/C1=CC=CS1 MCULE-5564124883 [0,1,0,0,0,0|0,1,0]=2 115 B11R1.25 COC(=O)/C=C/C1=CNC=N1 MCULE-8157424577 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.25 COC(=O)/C=C/C1=CSC=C1 MCULE-9092301483 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.25 COC(=O)/C=C/C1=NC=CN1 MCULE-5392231331 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.25 COC(=O)C#CC1=CC=CS1 MCULE-9094321397 [0,1,0,0,0,0|0,1,2]=4 119 B11R1.25 COC(=O)C=CC1=CC=CN1 MCULE-2983330933 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.25 COC(=O)C=CC1=CC=CS1 MCULE-8316070904 [0,1,0,0,0,0|0,1,0]=2 121 B11R1.25 COC(=O)C=CC1=CN=CN1 MCULE-8998006253 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.25 COC(=O)C=CC1=CNC=N1 MCULE-6890357338 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.25 COC(=O)C=CC1=CSC=C1 MCULE-5382242747 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.25 COC(=O)CCC1=CC=CN1 MCULE-3378177183 [0,1,0,0,0,0|1,0,2]=4 125 B11R1.25 COC(=O)CCC1=CC=CS1 MCULE-2290836142 [0,1,0,0,0,0|0,1,2]=4 126 B11R1.25 CSC(=N)NCC1=CC=CO1 MCULE-1222298418 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.25 CSC(=N)NCC1=CC=CO1 MCULE-2766058747 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.25 NCC(=O)NCC1=CC=CO1 MCULE-9302287426 [0,1,0,0,0,0|1,0,1]=3 129 B11R1.25 NCC(=O)NCC1=CC=CO1 MCULE-9829892705 [0,1,0,0,0,0|1,0,1]=3 130 B11R1.25 NNC(=O)CCC1=CC=CO1 MCULE-2610803816 [0,1,0,0,0,0|1,0,2]=4 131 B11R1.25 NNC(=O)NCC1=CC=CO1 MCULE-4009812439 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.25 O=C(CBr)NCC1=CC=CO1 MCULE-1808192006 [0,1,0,0,0,0|1,0,1]=3 133 B11R1.25 O=C(CBr)NCC1=CC=CS1 MCULE-3638675359 [0,1,0,0,0,0|1,1,1]=4 134 B11R1.25 O=C(CCl)NCC1=CC=CO1 MCULE-5793211356 [0,1,0,0,0,0|1,0,1]=3 135 B11R1.25 O=C(CCl)NCC1=CC=CS1 MCULE-8042041374 [0,1,0,0,0,0|1,1,1]=4 136 B11R1.35 CC(=CC1=CC=CO1)C(=O)O MCULE-2925151764 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.35 CC(=CC1=CC=CO1)[N+](=O)[O-] MCULE-6783990369 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.35 CC(=CC1=CC=CS1)C(=O)O MCULE-9297953193 [0,1,0,0,0,0|1,1,0]=3 139 B11R1.35 CC(=CC1=CC=CS1)[N+](=O)[O-] MCULE-8427510125 [0,1,0,0,0,0|2,1,0]=4 140 B11R1.35 CC(CC1=CC=CO1)C(=O)O MCULE-4967866488 [0,1,0,0,0,0|1,0,2]=4 141 B11R1.35 CS(=O)C(=CC1=CC=CS1)Cl MCULE-6619778436 [0,1,0,0,0,0|1,1,0]=3 142 B11R1.35 C[C@H](NC1=CC=CO1)C(=O)O MCULE-9956836124 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-2615027072 [0,1,0,0,0,0|1,0,2]=4 144 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-5961212744 [0,1,0,0,0,0|1,0,2]=4 145 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-2369724288 [0,1,0,0,0,0|1,0,2]=4 146 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5803182238 [0,1,0,0,0,0|1,0,2]=4 147 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5920888333 [0,1,0,0,0,0|1,0,2]=4 148 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-9717464601 [0,1,0,0,0,0|1,0,2]=4 149 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-2460207628 [0,1,0,0,0,0|1,0,2]=4 150 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-6984530934 [0,1,0,0,0,0|1,0,2]=4 151 B11R1.35 O=C(O)C(=CC1=CC=CO1)S MCULE-7963054894 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.35 O=C(O)C(=O)CC1=CC=CS1 MCULE-8806340356 [0,1,0,0,0,0|1,1,1]=4 153 B11R1.75 CC(=O)C=CC1=CC=C(O1)C MCULE-7777353808 [0,1,0,0,0,0|0,0,0]=1 154 B11R1.75 CC(=O)CCC1=CC=C(S1)Cl MCULE-1642922072 [0,1,0,0,0,0|0,1,2]=4 155 B11R1.75 CC(=O)OCC1=CC(=NO1)C MCULE-3999429125 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.75 CC(=O)SCC1=CC(=CS1)Br MCULE-6460082219 [0,1,0,0,0,0|1,1,1]=4 157 B11R1.75 CC1=CC(=NO1)/C=C/C(=O)O MCULE-5730179319 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.75 CC1=CC(=NO1)C=CC(=O)O MCULE-6910277257 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.75 CC1=CC=C(O1)/C=C/C(=O)Cl MCULE-3498227305 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.75 CC1=CC=C(O1)/C=C/C(=O)O MCULE-7844851375 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.75 CC1=CC=C(O1)/C=C/N(=O)=O MCULE-4090515360 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.75 CC1=CC=C(O1)C=CC(=O)Cl MCULE-6694263292 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.75 CC1=CC=C(O1)C=CC(=O)N MCULE-4747615229 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.75 CC1=CC=C(O1)C=CC(=O)O MCULE-2923544664 [0,1,0,0,0,0|1,0,0]=2 165 B11R1.75 CC1=CC=C(O1)C=C[N+](=O)[O-] MCULE-3846049313 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.75 CC1=CC=C(O1)CCC(=O)N MCULE-3566354504 [0,1,0,0,0,0|1,0,2]=4 167 B11R1.75 CC1=CC=C(O1)CCC(=O)O MCULE-6067365329 [0,1,0,0,0,0|1,0,2]=4 168 B11R1.75 CC1=CC=C(S1)/C=C/C(=O)O MCULE-4670055713 [0,1,0,0,0,0|1,1,0]=3 169 B11R1.75 CC1=CC=C(S1)C=CC(=O)O MCULE-8372699009 [0,1,0,0,0,0|1,1,0]=3 170 B11R1.75 CC1=COC(=N1)C=CC(=O)O MCULE-4453363575 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.75 CC1=CSC(=C1)/C=C/C(=O)O MCULE-6467593472 [0,1,0,0,0,0|1,1,0]=3 172 B11R1.75 CC1=NC(=CS1)C=CC(=O)O MCULE-2249538705 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.75 CC1=NSC(=C1)/C=C/C(=O)O MCULE-7759289655 [0,1,0,0,0,0|2,1,0]=4 174 B11R1.75 CC1=NSC(=C1)C=CC(=O)O MCULE-1689795440 [0,1,0,0,0,0|2,1,0]=4 175 B11R1.75 CN1C=CC(=N1)C=CC(=O)O MCULE-3022334975 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.75 CN1C=NC(=C1)C=CC(=O)O MCULE-4071980192 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.75 CN1C=NC(=C1)C=CC(=O)O MCULE-8917973345 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.75 NC(=O)C=CC1=CC=C(S1)Br MCULE-5432626188 [0,1,0,0,0,0|1,1,0]=3 179 B11R1.75 O=C(O)/C=C/C1=CC(=CS1)Br MCULE-8144525587 [0,1,0,0,0,0|1,1,0]=3 180 B11R1.75 O=C(O)/C=C/C1=CC=C(O1)Br MCULE-4754694343 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.75 O=C(O)/C=C/C1=CC=C(S1)Br MCULE-6931620559 [0,1,0,0,0,0|1,1,0]=3 182 B11R1.75 O=C(O)/C=C/C1=CSC(=C1)Br MCULE-5276056633 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.75 O=C(O)C=CC1=CC(=CS1)Br MCULE-2182030384 [0,1,0,0,0,0|1,1,0]=3 184 B11R1.75 O=C(O)C=CC1=CC=C(O1)Br MCULE-4405271455 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.75 O=C(O)C=CC1=CC=C(O1)I MCULE-6994174349 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.75 O=C(O)C=CC1=CC=C(S1)Br MCULE-2801862894 [0,1,0,0,0,0|1,1,0]=3 187 B11R1.75 O=[N+]([O-])C=CC1=CC(=CS1)Br MCULE-4095978435 [0,1,0,0,0,0|2,1,0]=4 188 B11R1.75 O=[N+]([O-])C=CC1=CC=C(S1)Cl MCULE-8273211355 [0,1,0,0,0,0|2,1,0]=4 189 B11R1.77 C=C(C)C[C@@H](N)C1=CC=CO1 MCULE-2477733116 [0,1,0,0,0,0|1,0,2]=4 190 B11R1.77 C=C(C)C[C@@H](N)C1=CC=CO1 MCULE-3102221936 [0,1,0,0,0,0|1,0,2]=4 191 B11R1.77 C=C(C)C[C@H](N)C1=CC=CO1 MCULE-4349563841 [0,1,0,0,0,0|1,0,2]=4 192 B11R1.77 C=C(C)C[C@H](N)C1=CC=CO1 MCULE-7824068427 [0,1,0,0,0,0|1,0,2]=4 193 B11R1.77 CC(=CC(=O)C1=CC=CS1)C MCULE-6627400241 [0,1,0,0,0,0|1,1,0]=3 194 B11R1.77 CC(=CC(=O)O)C1=CC=CO1 MCULE-2254303624 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.77 CC(=CC(=O)O)C1=CC=CS1 MCULE-7179456295 [0,1,0,0,0,0|1,1,0]=3 196 B11R1.77 CC(=O)CC(=O)C1=CC=CO1 MCULE-1620092656 [0,1,0,0,0,0|0,0,1]=2 197 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 MCULE-3430263061 [0,1,0,0,0,0|0,1,1]=3 198 B11R1.77 CC(=O)CC(=O)C1=CSC=C1 MCULE-9584861281 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.77 CC(=O)OC(=C1C=CC=C1)C MCULE-5146801070 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.77 CC(C)OC(=O)C1=CC=CO1 MCULE-1049013715 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.77 CC(CC(=O)O)C1=CC=CO1 MCULE-1929187509 [0,1,0,0,0,0|1,0,2]=4 202 B11R1.77 CC(N)CC(=O)C1=CC=CO1 MCULE-7249531333 [0,1,0,0,0,0|1,0,2]=4 203 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4837417792 [0,1,0,0,0,0|1,0,2]=4 204 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4958340543 [0,1,0,0,0,0|1,0,2]=4 205 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-3487071362 [0,1,0,0,0,0|1,0,2]=4 206 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6738812017 [0,1,0,0,0,0|1,0,2]=4 207 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6817919574 [0,1,0,0,0,0|1,0,2]=4 208 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-1644247813 [0,1,0,0,0,0|1,0,2]=4 209 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-3339059246 [0,1,0,0,0,0|1,0,2]=4 210 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9235419752 [0,1,0,0,0,0|1,0,2]=4 211 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9295639672 [0,1,0,0,0,0|1,0,2]=4 212 B11R1.77 O=C(O)CC(=O)C1=CC=CO1 MCULE-2623089072 [0,1,0,0,0,0|1,0,1]=3 213 B11R1.90 CC(=O)/C=C/C1=CC=NN1C MCULE-5243190468 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.90 CC(=O)C=CC1=CC=NN1C MCULE-7276421306 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.90 CC1=C(C=CO1)/C=C/C(=O)O MCULE-6630063140 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.90 CC1=C(C=CO1)C=CC(=O)O MCULE-1016825019 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.90 CC1=C(NC=N1)/C=C/C(=O)O MCULE-9497599005 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.90 CC1=C(SC=C1)/C=C/C(=O)O MCULE-7874369652 [0,1,0,0,0,0|1,1,0]=3 219 B11R1.90 CC1=C(SC=C1)/C=C/N(=O)=O MCULE-9177768253 [0,1,0,0,0,0|2,1,0]=4 220 B11R1.90 CC1=C(SC=C1)C=CC(=O)O MCULE-5468660790 [0,1,0,0,0,0|1,1,0]=3 221 B11R1.90 CC1=C(SC=C1)C=C[N+](=O)[O-] MCULE-4963113563 [0,1,0,0,0,0|2,1,0]=4 222 B11R1.90 CN1C=CC=C1/C=C/C(=O)O MCULE-8772811585 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.90 CN1C=CC=C1C=CC(=O)O MCULE-9069821546 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.90 CN1C=CC=C1C=C[N+](=O)[O-] MCULE-9607297411 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.90 CN1C=CN=C1C=CC(=O)O MCULE-9018628583 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.90 CN1C=NC=C1C=CC(=O)O MCULE-7025934558 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.90 CN1N=CC=C1/C=C/C(=O)O MCULE-8102308433 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.90 CN1N=CC=C1C=CC(=O)O MCULE-5235441977 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.510 CS(=O)(=O)NCC1=CC=CO1 MCULE-9219369184 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.510 CS(=O)(=O)[N-]CC1=CC=CO1 MCULE-2042083909 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.510 CS(=O)(=O)[N-]CC1=CC=CO1 MCULE-7848407594 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.510 O=S(=O)(F)C=CC1=CC=CO1 MCULE-4731228412 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.510 O=S(=O)(F)C=CC1=CC=CS1 MCULE-5506963755 [0,1,0,0,0,0|2,1,0]=4 234 B9R0.2 C/C=C/C=C/C=C/C(=O)O MCULE-6705197372 [0,0,1,0,0,0|2,0,0]=3 235 B9R0.2 CC=CC=CCOC(=O)C MCULE-6151366522 [0,0,1,0,0,0|2,0,1]=4 236 B9R0.48 CCOC(=O)/C=C/C(=O)C MCULE-1277426448 [0,0,1,0,0,0|1,0,2]=4 237 B9R0.48 CCOC(=O)C=CC(=O)C MCULE-7029387078 [0,0,1,0,0,0|1,0,2]=4 238 B11R2.36 BrC1=CC2=C(C=C1)OC=C2 MCULE-4241771020 [0,0,0,1,0,0|1,0,1]=3 239 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 MCULE-3201284890 [0,0,0,1,0,0|2,0,1]=4 240 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 MCULE-5190397824 [0,0,0,1,0,0|2,0,1]=4 241 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 MCULE-2463511675 [0,0,0,1,0,0|1,1,1]=4 242 B11R2.36 BrC1=CC2=C(N=C1)OC=C2 MCULE-3382352095 [0,0,0,1,0,0|2,0,1]=4 243 B11R2.36 BrC1=CC=C2CC=CC2=C1 MCULE-5402289408 [0,0,0,1,0,0|2,0,1]=4 244 B11R2.36 BrC1=CC=C2NC=CC2=C1 MCULE-7541905570 [0,0,0,1,0,0|2,0,1]=4 245 B11R2.36 BrC1=CC=C2NC=CC2=N1 MCULE-2143905681 [0,0,0,1,0,0|3,0,0]=4 246 B11R2.36 BrC1=CC=C2OC=CC2=N1 MCULE-3354409425 [0,0,0,1,0,0|2,0,0]=3 247 B11R2.36 BrC1=CC=C2OC=NC2=N1 MCULE-2734365343 [0,0,0,1,0,0|3,0,0]=4 248 B11R2.36 BrC1=CN2C=CC=C2C=C1 MCULE-4851618966 [0,0,0,1,0,0|2,0,1]=4 249 B11R2.36 BrC1=NC2=C(C=C1)SC=C2 MCULE-7856426455 [0,0,0,1,0,0|2,1,0]=4 250 B11R2.36 CC1=CC2=C(C=C1)N=CS2 MCULE-4998017366 [0,0,0,1,0,0|3,0,0]=4 251 B11R2.36 CC1=CC2=C(C=C1)NC=C2 MCULE-2611227888 [0,0,0,1,0,0|2,0,0]=3 252 B11R2.36 CC1=CC2=C(C=C1)OC=C2 MCULE-2475611374 [0,0,0,1,0,0|1,0,0]=2 253 B11R2.36 CC1=CC2=C(C=C1)OC=N2 MCULE-7433438743 [0,0,0,1,0,0|2,0,0]=3 254 B11R2.36 CC1=CC2=C(C=C1)OCO2 MCULE-7587943376 [0,0,0,1,0,0|2,0,1]=4 255 B11R2.36 CC1=CC2=C(C=C1)ON=C2 MCULE-2357661636 [0,0,0,1,0,0|2,0,0]=3 256 B11R2.36 CC1=CC2=C(C=C1)SC=C2 MCULE-7349743382 [0,0,0,1,0,0|1,1,0]=3 257 B11R2.36 CC1=CC2=C(C=CC2)C=C1 MCULE-8450576084 [0,0,0,1,0,0|2,0,1]=4 258 B11R2.36 CC1=CC2=C(C=CN2)C=C1 MCULE-1566062876 [0,0,0,1,0,0|3,0,0]=4 259 B11R2.36 CC1=CC2=C(C=N1)NC=C2 MCULE-7165013882 [0,0,0,1,0,0|3,0,0]=4 260 B11R2.36 CC1=CC2=CC=NN2C=C1 MCULE-6896518001 [0,0,0,1,0,0|3,0,0]=4 261 B11R2.36 CC1=CC=C2C=COC2=C1 MCULE-7212423912 [0,0,0,1,0,0|3,0,0]=4 262 B11R2.36 CC1=CC=C2C=CSC2=C1 MCULE-7049254624 [0,0,0,1,0,0|3,0,0]=4 263 B11R2.36 CC1=CC=C2N=CC=C2N1 MCULE-1480451927 [0,0,0,1,0,0|2,0,0]=3 264 B11R2.36 CC1=CC=C2N=CNC2=N1 MCULE-7195302629 [0,0,0,1,0,0|3,0,0]=4 265 B11R2.36 CC1=CC=C2N=COC2=C1 MCULE-4411402928 [0,0,0,1,0,0|3,0,0]=4 266 B11R2.36 CC1=CC=C2N=CSC2=N1 MCULE-3945876562 [0,0,0,1,0,0|3,0,0]=4 267 B11R2.36 CC1=CC=C2NC=NC2=C1 MCULE-9032121446 [0,0,0,1,0,0|3,0,0]=4 268 B11R2.36 CC1=CC=C2NN=CC2=C1 MCULE-3999988622 [0,0,0,1,0,0|3,0,0]=4 269 B11R2.36 CC1=CC=C2SC=CC2=N1 MCULE-8929526003 [0,0,0,1,0,0|1,1,0]=3 270 B11R2.36 CC1=CC=C2SC=NC2=C1 MCULE-5255172604 [0,0,0,1,0,0|2,1,0]=4 271 B11R2.36 CC1=CN2C=CN=C2C=C1 MCULE-1789008304 [0,0,0,1,0,0|3,0,0]=4 272 B11R2.36 CC1=CN2C=CN=C2C=C1 MCULE-8585423200 [0,0,0,1,0,0|3,0,0]=4 273 B11R2.36 CC1=CN2C=NC=C2C=C1 MCULE-5872034191 [0,0,0,1,0,0|3,0,0]=4 274 B11R2.36 CC1=CN2N=CC=C2C=C1 MCULE-8281270274 [0,0,0,1,0,0|3,0,0]=4 275 B11R2.36 CC1=CN=C2NC=CC2=C1 MCULE-4078483041 [0,0,0,1,0,0|3,0,0]=4 276 B11R2.36 CC1=NC2=C(C=C1)NC=C2 MCULE-2905365174 [0,0,0,1,0,0|2,0,0]=3 277 B11R2.36 CC1=NC2=C(C=C1)NN=C2 MCULE-3857658352 [0,0,0,1,0,0|3,0,0]=4 278 B11R2.36 CC1=NC2=C(C=C1)[Se]C=C2 MCULE-1965989991 [0,0,0,1,0,0|1,1,0]=3 279 B11R2.36 CC1=NC2=C(C=CN2)C=C1 MCULE-6924638795 [0,0,0,1,0,0|3,0,0]=4 280 B11R2.36 CC1=NC2=C(C=N1)SC=C2 MCULE-2866267280 [0,0,0,1,0,0|2,1,0]=4 281 B11R2.36 CC1=NC2=CC=NN2C=C1 MCULE-5817837907 [0,0,0,1,0,0|3,0,0]=4 282 B11R2.36 CC1=NN2C=CN=C2C=C1 MCULE-6806701278 [0,0,0,1,0,0|3,0,0]=4 283 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 MCULE-1908722843 [0,0,0,1,0,0|2,0,1]=4 284 B11R2.36 ClC1=CC2=C(C=C1)ON=C2 MCULE-2654133565 [0,0,0,1,0,0|2,0,1]=4 285 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 MCULE-6560834785 [0,0,0,1,0,0|1,1,1]=4 286 B11R2.36 ClC1=CC2=C(C=N1)OC=C2 MCULE-3971979319 [0,0,0,1,0,0|2,0,1]=4 287 B11R2.36 ClC1=CC=C2CC=CC2=C1 MCULE-9024715118 [0,0,0,1,0,0|2,0,1]=4 288 B11R2.36 ClC1=CC=C2NC=CC2=N1 MCULE-1912999836 [0,0,0,1,0,0|3,0,0]=4 289 B11R2.36 ClC1=CC=C2OC=CC2=C1 MCULE-4353400853 [0,0,0,1,0,0|1,0,1]=3 290 B11R2.36 ClC1=CC=C2OC=CC2=N1 MCULE-7037356034 [0,0,0,1,0,0|2,0,0]=3 291 B11R2.36 ClC1=CC=C2OC=NC2=C1 MCULE-4297375396 [0,0,0,1,0,0|2,0,1]=4 292 B11R2.36 ClC1=CN2C=CC=C2C=C1 MCULE-2396788582 [0,0,0,1,0,0|2,0,1]=4 293 B11R2.36 ClC1=NC2=C(C=C1)SC=C2 MCULE-1489093360 [0,0,0,1,0,0|2,1,0]=4 294 B11R2.36 ClC1=NC=C2OC=CC2=N1 MCULE-1866568442 [0,0,0,1,0,0|3,0,0]=4 295 B11R2.36 FC1=CC2=C(C=C1)NC=C2 MCULE-8267625259 [0,0,0,1,0,0|2,0,1]=4 296 B11R2.36 FC1=CC2=C(C=C1)OC=C2 MCULE-4455880413 [0,0,0,1,0,0|1,0,1]=3 297 B11R2.36 FC1=CC2=C(C=C1)OC=N2 MCULE-4871241857 [0,0,0,1,0,0|2,0,1]=4 298 B11R2.36 FC1=CC2=C(C=C1)SC=C2 MCULE-3284696766 [0,0,0,1,0,0|1,1,1]=4 299 B11R2.36 FC1=CC=C2CC=CC2=C1 MCULE-2943317903 [0,0,0,1,0,0|2,0,1]=4 300 B11R2.36 FC1=CC=C2N=CC=C2N1 MCULE-9425206158 [0,0,0,1,0,0|3,0,0]=4 301 B11R2.36 FC1=NC2=C(C=C1)NC=C2 MCULE-7583536381 [0,0,0,1,0,0|3,0,0]=4 302 B11R2.36 IC1=CC2=C(C=C1)CC=C2 MCULE-2703068624 [0,0,0,1,0,0|2,0,1]=4 303 B11R2.36 IC1=CC2=C(C=C1)SC=C2 MCULE-7011936989 [0,0,0,1,0,0|1,1,1]=4 304 B11R2.36 IC1=CC=C2NC=CC2=C1 MCULE-8201893158 [0,0,0,1,0,0|2,0,1]=4 305 B11R2.36 IC1=CC=C2OC=CC2=C1 MCULE-9906771533 [0,0,0,1,0,0|1,0,1]=3 306 B11R2.36 IC1=CC=C2ON=CC2=C1 MCULE-9084259647 [0,0,0,1,0,0|2,0,1]=4 307 B11R2.36 NC1=CC2=C(C=C1)NC=C2 MCULE-5320371809 [0,0,0,1,0,0|2,0,1]=4 308 B11R2.36 NC1=CC2=C(C=C1)OC=C2 MCULE-7015055699 [0,0,0,1,0,0|1,0,1]=3 309 B11R2.36 NC1=CC2=C(C=C1)OC=N2 MCULE-7786553742 [0,0,0,1,0,0|2,0,1]=4 310 B11R2.36 NC1=CC2=C(C=C1)ON=C2 MCULE-2722906180 [0,0,0,1,0,0|2,0,1]=4 311 B11R2.36 NC1=CC2=C(C=C1)SC=C2 MCULE-2102098031 [0,0,0,1,0,0|1,1,1]=4 312 B11R2.36 NC1=CC2=C(C=C1)SC=C2 MCULE-8605458745 [0,0,0,1,0,0|1,1,1]=4 313 B11R2.36 NC1=CC=C2N=CC=C2N1 MCULE-1462949238 [0,0,0,1,0,0|3,0,0]=4 314 B11R2.36 NC1=CC=C2N=CC=C2N1 MCULE-7664911346 [0,0,0,1,0,0|3,0,0]=4 315 B11R2.36 NC1=CC=C2NC=CC2=C1 MCULE-5140857191 [0,0,0,1,0,0|2,0,1]=4 316 B11R2.36 NC1=CC=C2NC=CC2=N1 MCULE-7582339013 [0,0,0,1,0,0|3,0,0]=4 317 B11R2.36 NC1=CC=C2OC=NC2=C1 MCULE-9790732617 [0,0,0,1,0,0|2,0,1]=4 318 B11R2.36 NC1=CN2C=CC=C2C=C1 MCULE-2668098342 [0,0,0,1,0,0|2,0,1]=4 319 B11R2.36 NC1=CN=C2OC=CC2=C1 MCULE-2032244985 [0,0,0,1,0,0|2,0,1]=4 320 B11R2.36 NC1=NC2=C(C=C1)NC=C2 MCULE-9117986838 [0,0,0,1,0,0|3,0,0]=4 321 B11R2.36 O=C1C=CC2=C(N1)C=NN2 MCULE-4444779209 [0,0,0,1,0,0|3,0,0]=4 322 B11R2.36 O=C1C=CC2=C(N1)NC=C2 MCULE-4709006502 [0,0,0,1,0,0|3,0,0]=4 323 B11R2.36 O=C1C=CN2N=CC=C2N1 MCULE-1796983742 [0,0,0,1,0,0|3,0,0]=4 324 B11R2.36 O=C1C=CN2NC=CC2=C1 MCULE-1796308436 [0,0,0,1,0,0|2,0,1]=4 325 B11R2.36 O=C1C=CN2NC=CC2=N1 MCULE-7680742754 [0,0,0,1,0,0|3,0,0]=4 326 B11R2.36 O=C1CCC2=C(C1)C=CN2 MCULE-4113637130 [0,0,0,1,0,0|1,0,2]=4 327 B11R2.36 O=C1CCC2=C(C1)C=CS2 MCULE-9504436564 [0,0,0,1,0,0|0,1,2]=4 328 B11R2.36 OC1=CC2=C(C=C1)NC=C2 MCULE-4047358382 [0,0,0,1,0,0|1,0,2]=4 329 B11R2.36 OC1=CC2=C(C=C1)SC=C2 MCULE-1314735878 [0,0,0,1,0,0|0,1,2]=4 330 B11R2.36 OC1=CC=C2NC=CC2=N1 MCULE-6460124175 [0,0,0,1,0,0|2,0,1]=4 331 B11R2.36 OC1=CC=C2OC=CC2=C1 MCULE-9887853887 [0,0,0,1,0,0|0,0,2]=3 332 B11R2.36 OC1=CC=C2OC=NC2=C1 MCULE-9369337908 [0,0,0,1,0,0|1,0,2]=4 333 B11R2.36 OC1=NC2=C(C=C1)NC=C2 MCULE-7005906533 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.36 SC1=CC2=C(C=C1)OC=C2 MCULE-9141806342 [0,0,0,1,0,0|0,1,1]=3 335 B9R1.13 BrC(=CC1=CC=CO1)Br MCULE-3343272789 [0,0,0,0,1,0|2,0,0]=3 336 B9R1.13 C=C(C)CC1=CC=CO1 MCULE-4120425400 [0,0,0,0,1,0|1,0,1]=3 337 B9R1.13 C=C(C)CC1=CC=CS1 MCULE-7442921300 [0,0,0,0,1,0|1,1,1]=4 338 B9R1.13 CC(=O)CC1=CC=CO1 MCULE-3781634843 [0,0,0,0,1,0|0,0,1]=2 339 B9R1.13 CC(=O)CC1=CC=CS1 MCULE-9004703203 [0,0,0,0,1,0|0,1,1]=3 340 B9R1.13 CC(=O)CC1=CC=NO1 MCULE-9545444993 [0,0,0,0,1,0|1,0,1]=3 341 B9R1.13 CC(=O)CC1=CN=CS1 MCULE-8783347852 [0,0,0,0,1,0|1,1,1]=4 342 B9R1.13 CC(=O)CC1=COC=C1 MCULE-2428760368 [0,0,0,0,1,0|2,0,1]=4 343 B9R1.13 CC(=O)CC1=CSC=C1 MCULE-1364443363 [0,0,0,0,1,0|2,0,1]=4 344 B9R1.13 CC(=O)CN1C=CC=N1 MCULE-2312268519 [0,0,0,0,1,0|2,0,1]=4 345 B9R1.13 CC(=O)CN1C=CC=N1 MCULE-7407119287 [0,0,0,0,1,0|2,0,1]=4 346 B9R1.13 CC(=O)NC1=CC=CO1 MCULE-6766243633 [0,0,0,0,1,0|1,0,0]=2 347 B9R1.13 CC(=O)NC1=CC=CS1 MCULE-2977108636 [0,0,0,0,1,0|1,1,0]=3 348 B9R1.13 CC(=O)NC1=CC=NN1 MCULE-2847031032 [0,0,0,0,1,0|3,0,0]=4 349 B9R1.13 CC(=O)NC1=CSC=C1 MCULE-4876700541 [0,0,0,0,1,0|3,0,0]=4 350 B9R1.13 CC(=O)NC1=NC=CN1 MCULE-1210151356 [0,0,0,0,1,0|3,0,0]=4 351 B9R1.13 CC(=O)NC1=NC=CS1 MCULE-2195241325 [0,0,0,0,1,0|2,1,0]=4 352 B9R1.13 CC(N)CC1=CC=CO1 MCULE-3146116219 [0,0,0,0,1,0|1,0,2]=4 353 B9R1.13 CC(N)CC1=CC=CO1 MCULE-4578762065 [0,0,0,0,1,0|1,0,2]=4 354 B9R1.13 CC(O)CC1=CC=CO1 MCULE-5714080569 [0,0,0,0,1,0|0,0,3]=4 355 B9R1.13 CN(C)C=C1C=CC=C1 MCULE-3965444711 [0,0,0,0,1,0|3,0,0]=4 356 B9R1.13 CN(C)CC1=CC=CO1 MCULE-6961476261 [0,0,0,0,1,0|2,0,1]=4 357 B9R1.13 NC(=O)CC1=CC=CS1 MCULE-6510920095 [0,0,0,0,1,0|1,1,1]=4 358 B9R1.13 O=C(Cl)CC1=CC=CO1 MCULE-9542407975 [0,0,0,0,1,0|1,0,1]=3 359 B9R1.13 O=C(Cl)CC1=CC=CS1 MCULE-3077784578 [0,0,0,0,1,0|1,1,1]=4 360 B9R1.13 O=C(O)CC1=CC=CN1 MCULE-7285438888 [0,0,0,0,1,0|2,0,1]=4 361 B9R1.13 O=C(O)CC1=CC=CO1 MCULE-8441709842 [0,0,0,0,1,0|1,0,1]=3 362 B9R1.13 O=C(O)CC1=CC=CS1 MCULE-7149489344 [0,0,0,0,1,0|1,1,1]=4 363 B9R1.13 O=C(O)CC1=CC=NO1 MCULE-1530103657 [0,0,0,0,1,0|2,0,1]=4 364 B9R1.13 O=C(O)CC1=CN=CO1 MCULE-6840081660 [0,0,0,0,1,0|2,0,1]=4 365 B11R1.91 C(=CC1=CC=CC=C1)C(=O)[O-] MCULE-4187228018 [0,0,0,0,0,1|2,0,0]=3 366 B11R1.91 CC(=CCC1=CC=CC=C1)C MCULE-6894689571 [0,0,0,0,0,1|2,0,1]=4 367 B11R1.91 CC(=CSC1=CC=CC=C1)C MCULE-2813813789 [0,0,0,0,0,1|3,0,0]=4 368 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 MCULE-4879858540 [0,0,0,0,0,1|1,0,0]=2 369 B11R1.91 CC(=O)/N=N/C1=CC=CC=C1 MCULE-3182323500 [0,0,0,0,0,1|3,0,0]=4 370 B11R1.91 CC(=O)C#CC1=CC=CC=C1 MCULE-7514493825 [0,0,0,0,0,1|1,0,2]=4 371 B11R1.91 CC(=O)C=CC1=CC=CC=C1 MCULE-5202944660 [0,0,0,0,0,1|1,0,0]=2 372 B11R1.91 CC(=O)C=CC1=CC=NC=C1 MCULE-8574000031 [0,0,0,0,0,1|1,0,0]=2 373 B11R1.91 CC(=O)C=CC1=CC=[NH+]C=C1 MCULE-7155207460 [0,0,0,0,0,1|1,0,0]=2 374 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [0,0,0,0,0,1|1,0,2]=4 375 B11R1.91 CC(=O)CCC1=CN=CC=C1 MCULE-8978954109 [0,0,0,0,0,1|1,0,2]=4 376 B11R1.91 CC(=O)CCC1=NC=CC=C1 MCULE-2250801533 [0,0,0,0,0,1|1,0,2]=4 377 B11R1.91 CC(=O)COC1=CC=CC=C1 MCULE-8124389556 [0,0,0,0,0,1|2,0,1]=4 378 B11R1.91 CC(=O)COC1=NC=CC=C1 MCULE-9843455535 [0,0,0,0,0,1|2,0,1]=4 379 B11R1.91 CC(=O)CSC1=CC=CC=C1 MCULE-8704732850 [0,0,0,0,0,1|2,0,1]=4 380 B11R1.91 CC(=O)N=NC1=CC=CC=C1 MCULE-1771024632 [0,0,0,0,0,1|3,0,0]=4 381 B11R1.91 CC(=O)NCC1=CC=CC=C1 MCULE-2051924381 [0,0,0,0,0,1|2,0,1]=4 382 B11R1.91 CC(=O)NCC1=CC=NC=C1 MCULE-8645049472 [0,0,0,0,0,1|2,0,1]=4 383 B11R1.91 CC(=O)NCC1=CN=CC=C1 MCULE-8882042703 [0,0,0,0,0,1|2,0,1]=4 384 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-3133975600 [0,0,0,0,0,1|2,0,1]=4 385 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-5622133685 [0,0,0,0,0,1|2,0,1]=4 386 B11R1.91 CC(=O)NNC1=CC=CC=C1 MCULE-5989143063 [0,0,0,0,0,1|3,0,0]=4 387 B11R1.91 CC(=O)OCC1=CC=CC=C1 MCULE-7952998506 [0,0,0,0,0,1|2,0,1]=4 388 B11R1.91 CC(=O)OCC1=CC=NC=C1 MCULE-9787989740 [0,0,0,0,0,1|2,0,1]=4 389 B11R1.91 CC(=O)OCC1=NC=CC=C1 MCULE-8957630952 [0,0,0,0,0,1|2,0,1]=4 390 B11R1.91 CC(=O)OCC1=NC=CC=N1 MCULE-9700793157 [0,0,0,0,0,1|2,0,1]=4 391 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 MCULE-2518875564 [0,0,0,0,0,1|3,0,0]=4 392 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 MCULE-5081261516 [0,0,0,0,0,1|3,0,0]=4 393 B11R1.91 CC(=O)SCC1=CC=CN=C1 MCULE-4536121931 [0,0,0,0,0,1|2,0,1]=4 394 B11R1.91 CC(=O)SCC1=NC=CC=C1 MCULE-5300068362 [0,0,0,0,0,1|2,0,1]=4 395 B11R1.91 CC(=O)SSC1=CC=CC=C1 MCULE-9410782409 [0,0,0,0,0,1|3,0,0]=4 396 B11R1.91 CC(N)/C=C/C1=CC=CC=C1 MCULE-3107856596 [0,0,0,0,0,1|2,0,1]=4 397 B11R1.91 CC(N)/C=C/C1=CC=CC=C1 MCULE-3641949317 [0,0,0,0,0,1|2,0,1]=4 398 B11R1.91 CC(N)C=CC1=CC=CC=C1 MCULE-6210139879 [0,0,0,0,0,1|2,0,1]=4 399 B11R1.91 CC(N)C=CC1=CC=CC=C1 MCULE-9311329844 [0,0,0,0,0,1|2,0,1]=4 400 B11R1.91 CC(O)C=CC1=CC=CC=C1 MCULE-5117324409 [0,0,0,0,0,1|1,0,2]=4 401 B11R1.91 CC(O)C=CC1=CC=NC=C1 MCULE-6157195448 [0,0,0,0,0,1|1,0,2]=4 402 B11R1.91 CC(O)C=CC1=CN=CC=C1 MCULE-2639801613 [0,0,0,0,0,1|1,0,2]=4 403 B11R1.91 CC(O)C=CC1=NC=CC=C1 MCULE-7745477546 [0,0,0,0,0,1|1,0,2]=4 404 B11R1.91 C[C@H](O)/C=C/C1=CC=CC=C1 MCULE-7363806853 [0,0,0,0,0,1|1,0,2]=4 405 B11R1.91 C[C@H](O)C=CC1=CC=CC=C1 MCULE-4644208236 [0,0,0,0,0,1|1,0,2]=4 406 B11R1.91 N=C(N)C=CC1=CC=CC=C1 MCULE-6366105470 [0,0,0,0,0,1|3,0,0]=4 407 B11R1.91 N=C(N)C=CC1=CC=CC=C1 MCULE-8127898605 [0,0,0,0,0,1|3,0,0]=4 408 B11R1.91 NC(=O)/C=C/C1=CC=CC=C1 MCULE-1428301205 [0,0,0,0,0,1|2,0,0]=3 409 B11R1.91 NC(=O)C=CC1=CC=CC=C1 MCULE-9669016303 [0,0,0,0,0,1|2,0,0]=3 410 B11R1.91 O=C(Cl)/C=C/C1=CC=CC=C1 MCULE-4421630248 [0,0,0,0,0,1|2,0,0]=3 411 B11R1.91 O=C(Cl)/C=C/C1=CC=CN=C1 MCULE-9539270856 [0,0,0,0,0,1|2,0,0]=3 412 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 MCULE-8583623904 [0,0,0,0,0,1|2,0,0]=3 413 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 MCULE-1077406303 [0,0,0,0,0,1|2,0,0]=3 414 B11R1.91 O=C(O)/C=C/C1=CC=NC=C1 MCULE-7372485168 [0,0,0,0,0,1|2,0,0]=3 415 B11R1.91 O=C(O)/C=C/C1=CC=NN=C1 MCULE-4001426630 [0,0,0,0,0,1|3,0,0]=4 416 B11R1.91 O=C(O)/C=C/C1=CN=CC=C1 MCULE-7325423443 [0,0,0,0,0,1|2,0,0]=3 417 B11R1.91 O=C(O)/C=C/C1=NC=CC=C1 MCULE-3136346884 [0,0,0,0,0,1|2,0,0]=3 418 B11R1.91 O=C(O)/C=C/C1=NC=CC=N1 MCULE-3443030394 [0,0,0,0,0,1|2,0,0]=3 419 B11R1.91 O=C(O)/C=C/C1=NC=CN=C1 MCULE-3940861248 [0,0,0,0,0,1|2,0,0]=3 420 B11R1.91 O=C(O)C=CC1=CC=CC=C1 MCULE-4051659199 [0,0,0,0,0,1|2,0,0]=3 421 B11R1.91 O=C(O)C=CC1=CC=NC=C1 MCULE-1159332612 [0,0,0,0,0,1|2,0,0]=3 422 B11R1.91 O=C(O)C=CC1=CN=CC=C1 MCULE-8996562963 [0,0,0,0,0,1|2,0,0]=3 423 B11R1.91 O=C(O)C=CC1=CN=CN=C1 MCULE-6950095460 [0,0,0,0,0,1|3,0,0]=4 424 B11R1.91 O=C(O)C=CC1=NC=CC=C1 MCULE-8328935452 [0,0,0,0,0,1|2,0,0]=3 425 B11R1.91 O=C(O)C=CC1=NC=CC=N1 MCULE-2585714270 [0,0,0,0,0,1|2,0,0]=3 426 B11R1.91 O=C(O)C=CC1=NC=CN=C1 MCULE-1233705513 [0,0,0,0,0,1|2,0,0]=3 427 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-1063030896 [0,0,0,0,0,1|3,0,0]=4 428 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-9365726596 [0,0,0,0,0,1|3,0,0]=4 429 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-3275895563 [0,0,0,0,0,1|2,0,0]=3 430 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-6688127943 [0,0,0,0,0,1|2,0,0]=3 431 B11R1.91 O=C([O-])C=CC1=CC=CC=C1 MCULE-7412134653 [0,0,0,0,0,1|2,0,0]=3 432 B11R1.91 O=N(=O)/C=C/C1=CC=CC=C1 MCULE-6515844803 [0,0,0,0,0,1|3,0,0]=4 433 B11R1.91 O=N(=O)/C=C/C1=CC=CN=C1 MCULE-8717060212 [0,0,0,0,0,1|3,0,0]=4 434 B11R1.91 O=N(=O)/C=C/C1=CC=NC=C1 MCULE-7659396962 [0,0,0,0,0,1|3,0,0]=4 435 B11R1.91 O=N(=O)/C=C\C1=CC=NC=C1 MCULE-4185949367 [0,0,0,0,0,1|3,0,0]=4 436 B11R1.91 O=[N+]([O-])C=CC1=CC=CC=C1 MCULE-5467171038 [0,0,0,0,0,1|3,0,0]=4 437 B11R1.91 O=[N+]([O-])C=CC1=CC=CN=C1 MCULE-1779410044 [0,0,0,0,0,1|3,0,0]=4 438 B11R1.91 O=[N+]([O-])C=CC1=CC=NC=C1 MCULE-2092506538 [0,0,0,0,0,1|3,0,0]=4 439 B11R1.172 CC(=O)CSCC1=CC=CO1 MCULE-8946739392 [0,0,0,0,0,1|0,0,2]=3 440 B11R1.172 CC(=O)NN=CC1=CC=CO1 MCULE-5071283682 [0,0,0,0,0,1|1,0,0]=2 441 B11R1.172 N=C(N)NN=CC1=CC=CO1 MCULE-3941752943 [0,0,0,0,0,1|3,0,0]=4 442 B11R1.172 NC(=O)N/N=C/C1=CC=CS1 MCULE-4162505163 [0,0,0,0,0,1|2,1,0]=4 443 B11R1.172 NC(=O)NN=CC1=CC=CS1 MCULE-9292091464 [0,0,0,0,0,1|2,1,0]=4 444 B11R1.172 NC(=S)NN=CC1=CC=CO1 MCULE-4688783268 [0,0,0,0,0,1|2,1,0]=4 445 B11R1.172 O=C(O)CNCC1=CC=CO1 MCULE-3294949215 [0,0,0,0,0,1|1,0,2]=4 446 B11R1.172 O=C(O)COCC1=CC=CO1 MCULE-2722649918 [0,0,0,0,0,1|1,0,2]=4 447 B11R1.172 O=C(O)CSCC1=CC=CO1 MCULE-2797657778 [0,0,0,0,0,1|1,0,2]=4 448 B11R1.172 O=C([O-])COCC1=CC=CO1 MCULE-3260300210 [0,0,0,0,0,1|1,0,2]=4 449 B11R1.172 O=N(=O)C/C=C/C1=CC=CO1 MCULE-6756766903 [0,0,0,0,0,1|2,0,0]=3 450 B8R0.4 CC=CC=CC=CC=O MCULE-4270643488 [1,0,1,0,0,0|0,0,1]=3 451 B8R0.9 COC(=O)/C=C/C(=O)C MCULE-7597345789 [1,0,1,0,0,0|1,0,1]=4 452 B8R0.9 COC(=O)C=CC(=O)C MCULE-5746687781 [1,0,1,0,0,0|1,0,1]=4 453 B8R1.8 C=CCC1=CC=CS1 MCULE-7817434134 [2,0,0,0,0,0|0,1,1]=4 454 B8R1.8 CC=CN1C=CC=C1 MCULE-9177139141 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.8 CCCC1=CC=CO1 MCULE-9366942285 [2,0,0,0,0,0|0,0,2]=4 456 B8R1.8 CNCC1=CC=CO1 MCULE-1710918294 [2,0,0,0,0,0|1,0,1]=4 457 B8R1.8 CNCC1=CC=CO1 MCULE-5299298318 [2,0,0,0,0,0|1,0,1]=4 458 B8R1.8 COCC1=CC=CO1 MCULE-8030118388 [2,0,0,0,0,0|1,0,1]=4 459 B8R1.8 CSCC1=CC=CO1 MCULE-5733837840 [2,0,0,0,0,0|1,0,1]=4 460 B8R1.8 O/N=C/C1=CC=CO1 MCULE-4188924462 [2,0,0,0,0,0|1,0,1]=4 461 B8R1.8 O=CCC1=CC=CS1 MCULE-8803167927 [2,0,0,0,0,0|0,1,1]=4 462 B8R1.8 ON=CC1=CC=CO1 MCULE-3931806527 [2,0,0,0,0,0|1,0,1]=4 463 B10R0.78 C=CCOC(=O)/C=C\C(=O)O MCULE-2115810478 [0,1,1,0,0,0|1,0,1]=4 464 B10R0.78 C=CCOC(=O)C=CC(=O)O MCULE-4313148570 [0,1,1,0,0,0|1,0,1]=4 465 B10R1.11 CC=CC(=O)C1=CC=CS1 MCULE-3729837760 [1,1,0,0,0,0|0,1,0]=3 466 B10R1.11 CCCC(=O)C1=CC=CO1 MCULE-9036040363 [1,1,0,0,0,0|0,0,2]=4 467 B10R1.11 CCOC(=O)C1=CC=CO1 MCULE-5049309997 [1,1,0,0,0,0|1,0,1]=4 468 B10R1.11 CNCC(=O)C1=CC=CO1 MCULE-8754624402 [1,1,0,0,0,0|1,0,1]=4 469 B10R1.11 O=CC=C(Cl)C1=CSC=C1 MCULE-9401380056 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.16 CC1=CC=C(O1)C=CC=O MCULE-3527866291 [1,1,0,0,0,0|0,0,0]=2 471 B10R1.16 CC1=CC=C(O1)CCC=O MCULE-6278960480 [1,1,0,0,0,0|0,0,2]=4 472 B10R1.16 CC1=CC=C(O1)CNC=O MCULE-3710701326 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.21 CNCC=CC1=CC=CS1 MCULE-9188616109 [1,1,0,0,0,0|0,1,1]=4 474 B10R1.27 C/C(=C\C1=CC=CO1)/C=O MCULE-3479276403 [1,1,0,0,0,0|0,0,0]=2 475 B10R1.27 CC(=CC1=CC=CO1)C=O MCULE-7398331146 [1,1,0,0,0,0|0,0,0]=2 476 B10R1.27 CCC(=O)CC1=CC=CO1 MCULE-6240079097 [1,1,0,0,0,0|0,0,2]=4 477 B10R1.27 COC(=O)CC1=CC=CO1 MCULE-3704769119 [1,1,0,0,0,0|1,0,1]=4 478 B10R1.29 CN1C=CC=C1C=CC=O MCULE-4325165250 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.23 C=C(C)C(=O)C1=CC=CS1 MCULE-3669511838 [0,1,0,0,1,0|1,1,0]=4 480 B10R1.23 CC(=O)C(=O)C1=CSC=C1 MCULE-6498632283 [0,1,0,0,1,0|2,0,0]=4 481 B10R1.23 CC(Br)C(=O)C1=CC=CO1 MCULE-5587099019 [0,1,0,0,1,0|1,0,1]=4 482 B10R1.23 CC(C(=O)O)C1=CC=CO1 MCULE-6443441937 [0,1,0,0,1,0|1,0,1]=4 483 B10R1.23 CC(C)C(=O)C1=CC=CO1 MCULE-6251458834 [0,1,0,0,1,0|1,0,1]=4 484 B10R1.23 CC(N)C(=O)C1=CC=CO1 MCULE-1502430285 [0,1,0,0,1,0|1,0,1]=4 485 B10R1.23 CC(N)C(=O)C1=CC=CO1 MCULE-4330835647 [0,1,0,0,1,0|1,0,1]=4 486 B10R1.23 CN(C)C(=O)C1=CC=CO1 MCULE-4234143990 [0,1,0,0,1,0|2,0,0]=4 487 B10R1.23 CN(O)C(=O)C1=CC=CO1 MCULE-9843941294 [0,1,0,0,1,0|1,0,1]=4 488 B10R1.23 NC(=O)C(=O)C1=CC=CO1 MCULE-8360919922 [0,1,0,0,1,0|1,0,0]=3 489 B10R1.23 NC(=O)C(=O)C1=CC=CS1 MCULE-7042640781 [0,1,0,0,1,0|1,1,0]=4 490 B10R1.23 NC(C(=O)O)C1=CC=CO1 MCULE-9043644841 [0,1,0,0,1,0|1,0,1]=4 491 B10R1.23 O=C(O)C(=O)C1=CC=CN1 MCULE-9607086039 [0,1,0,0,1,0|2,0,0]=4 492 B10R1.23 O=C(O)C(=O)C1=CC=CO1 MCULE-5129158726 [0,1,0,0,1,0|1,0,0]=3 493 B10R1.23 O=C(O)C(=O)C1=CC=CS1 MCULE-2381062967 [0,1,0,0,1,0|1,1,0]=4 494 B10R1.23 O=C(O)C(O)C1=CC=CO1 MCULE-1444782782 [0,1,0,0,1,0|1,0,1]=4 495 B10R1.54 CC(=O)NC1=CC(=NO1)C MCULE-3252754001 [0,1,0,0,1,0|2,0,0]=4 496 B10R1.54 CC(=O)NC1=CC=C(S1)Br MCULE-2561403972 [0,1,0,0,1,0|1,1,0]=4 497 B10R1.54 CC(=O)NC1C=CC(=O)O1 MCULE-9051685968 [0,1,0,0,1,0|1,0,1]=4 498 B10R1.54 CC1=CC=C(O1)CC(=O)O MCULE-4642905149 [0,1,0,0,1,0|1,0,1]=4 499 B10R1.64 CC(=O)OC1=C(C=CS1)N MCULE-6840281875 [0,1,0,0,1,0|1,1,0]=4 500 B10R1.64 CC1=C(OC=C1)CC(=O)O MCULE-1698084617 [0,1,0,0,1,0|1,0,1]=4 501 B10R1.64 O=C(O)CC1=C(C=CO1)Cl MCULE-9842926672 [0,1,0,0,1,0|1,0,1]=4 502 B12R1.21 C(=CC1=CC=C(C=C1)I)C(=O)N MCULE-4953492668 [0,1,0,0,0,1|2,0,0]=4 503 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-4968966219 [0,1,0,0,0,1|1,0,0]=3 504 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)C MCULE-1850770058 [0,1,0,0,0,1|1,0,0]=3 505 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-8042406157 [0,1,0,0,0,1|1,0,0]=3 506 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F MCULE-1896531163 [0,1,0,0,0,1|1,0,0]=3 507 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)O MCULE-3022611575 [0,1,0,0,0,1|1,0,0]=3 508 B12R1.21 CC(=O)/C=C/C1=NC=C(C=C1)C MCULE-5181621973 [0,1,0,0,0,1|1,0,0]=3 509 B12R1.21 CC(=O)/C=C/C1=NC=C(C=N1)F MCULE-1699754836 [0,1,0,0,0,1|1,0,0]=3 510 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Br MCULE-9469464573 [0,1,0,0,0,1|1,0,0]=3 511 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)C MCULE-3065183970 [0,1,0,0,0,1|1,0,0]=3 512 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4900585766 [0,1,0,0,0,1|1,0,0]=3 513 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)F MCULE-6872409442 [0,1,0,0,0,1|1,0,0]=3 514 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O MCULE-9722577866 [0,1,0,0,0,1|1,0,0]=3 515 B12R1.21 CC(=O)C=CC1=CC=[N+](C=C1)C MCULE-3808145366 [0,1,0,0,0,1|1,0,0]=3 516 B12R1.21 CC(=O)C=CC1=CC=[N+](C=C1)C MCULE-7841807344 [0,1,0,0,0,1|1,0,0]=3 517 B12R1.21 CC(=O)C=CC1=NC=C(C=C1)C MCULE-6162051128 [0,1,0,0,0,1|1,0,0]=3 518 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-2058495596 [0,1,0,0,0,1|2,0,0]=4 519 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4218057596 [0,1,0,0,0,1|2,0,0]=4 520 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)Cl MCULE-5021343987 [0,1,0,0,0,1|2,0,0]=4 521 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)N MCULE-5979163187 [0,1,0,0,0,1|2,0,0]=4 522 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O MCULE-7310353888 [0,1,0,0,0,1|2,0,0]=4 523 B12R1.21 CS(=O)C=CC1=CC=C(C=C1)Cl MCULE-5049709374 [0,1,0,0,0,1|2,0,0]=4 524 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-9474644627 [0,1,0,0,0,1|2,0,0]=4 525 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-4399110657 [0,1,0,0,0,1|2,0,0]=4 526 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)O MCULE-7972851464 [0,1,0,0,0,1|2,0,0]=4 527 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Br MCULE-2059664507 [0,1,0,0,0,1|2,0,0]=4 528 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9226277544 [0,1,0,0,0,1|2,0,0]=4 529 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)F MCULE-3516681833 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)O MCULE-1974045025 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6477711177 [0,1,0,0,0,1|2,0,0]=4 532 B12R1.21 NC1=CC=C(C=C1)C=CC(=O)O MCULE-9065250783 [0,1,0,0,0,1|2,0,0]=4 533 B12R1.21 NC1=NC=C(C=C1)/C=C/C(=O)O MCULE-9571181864 [0,1,0,0,0,1|2,0,0]=4 534 B12R1.21 NC1=NC=C(C=C1)C=CC(=O)O MCULE-9262977474 [0,1,0,0,0,1|2,0,0]=4 535 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Br MCULE-1656107943 [0,1,0,0,0,1|2,0,0]=4 536 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Cl MCULE-5462639794 [0,1,0,0,0,1|2,0,0]=4 537 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)F MCULE-3036184092 [0,1,0,0,0,1|2,0,0]=4 538 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Br MCULE-6741932936 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Cl MCULE-4301034303 [0,1,0,0,0,1|2,0,0]=4 540 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)F MCULE-4813703106 [0,1,0,0,0,1|2,0,0]=4 541 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br MCULE-4289979015 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl MCULE-4318861622 [0,1,0,0,0,1|2,0,0]=4 543 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F MCULE-9538614113 [0,1,0,0,0,1|2,0,0]=4 544 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)I MCULE-3328397950 [0,1,0,0,0,1|2,0,0]=4 545 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O MCULE-9551292063 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)S MCULE-2486115993 [0,1,0,0,0,1|2,0,0]=4 547 B12R1.21 O=C(O)/C=C/C1=CC=C(N=C1)Br MCULE-9625493002 [0,1,0,0,0,1|2,0,0]=4 548 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)Cl MCULE-4772490742 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-2551687293 [0,1,0,0,0,1|2,0,0]=4 550 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-9601983386 [0,1,0,0,0,1|2,0,0]=4 551 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Br MCULE-6214703716 [0,1,0,0,0,1|2,0,0]=4 552 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Cl MCULE-6051545485 [0,1,0,0,0,1|2,0,0]=4 553 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)F MCULE-8711973543 [0,1,0,0,0,1|2,0,0]=4 554 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)I MCULE-2006397145 [0,1,0,0,0,1|2,0,0]=4 555 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)O MCULE-2590309260 [0,1,0,0,0,1|2,0,0]=4 556 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)S MCULE-4579832892 [0,1,0,0,0,1|2,0,0]=4 557 B12R1.21 O=C(O)C=CC1=CC=C(N=C1)Br MCULE-1067022604 [0,1,0,0,0,1|2,0,0]=4 558 B12R1.21 O=C(O)C=CC1=CN=C(C=C1)Cl MCULE-5983392112 [0,1,0,0,0,1|2,0,0]=4 559 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-3616932768 [0,1,0,0,0,1|2,0,0]=4 560 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-9950644550 [0,1,0,0,0,1|2,0,0]=4 561 B12R1.21 [NH3+]C1=CC=C(C=C1)C=CC(=O)O MCULE-3210030968 [0,1,0,0,0,1|2,0,0]=4 562 B12R1.27 C/C(=N/O)/C=C/C1=CC=CC=C1 MCULE-1994376123 [0,1,0,0,0,1|1,0,1]=4 563 B12R1.27 CC(=NO)C=CC1=CC=CC=C1 MCULE-5760575133 [0,1,0,0,0,1|1,0,1]=4 564 B12R1.27 CNC(=O)C=CC1=CC=CC=C1 MCULE-9520300155 [0,1,0,0,0,1|1,0,0]=3 565 B12R1.27 COC(=O)/C=C/C1=CC=CC=C1 MCULE-2483911454 [0,1,0,0,0,1|1,0,0]=3 566 B12R1.27 COC(=O)/C=C/C1=CC=NC=C1 MCULE-6497290944 [0,1,0,0,0,1|1,0,0]=3 567 B12R1.27 COC(=O)/C=C/C1=CN=CC=C1 MCULE-5115987081 [0,1,0,0,0,1|1,0,0]=3 568 B12R1.27 COC(=O)C=CC1=CC=CC=C1 MCULE-1030097873 [0,1,0,0,0,1|1,0,0]=3 569 B12R1.27 COC(=O)C=CC1=CC=CN=C1 MCULE-1707015902 [0,1,0,0,0,1|1,0,0]=3 570 B12R1.27 COC(=O)C=CC1=CC=NC=C1 MCULE-9755170519 [0,1,0,0,0,1|1,0,0]=3 571 B12R1.27 COC(=O)C=CC1=CN=CN=C1 MCULE-7839991795 [0,1,0,0,0,1|2,0,0]=4 572 B12R1.27 COC(=O)C=CC1=NC=CC=C1 MCULE-9037911831 [0,1,0,0,0,1|1,0,0]=3 573 B12R1.27 COC(=O)C=CC1=NC=CN=C1 MCULE-2654585882 [0,1,0,0,0,1|1,0,0]=3 574 B12R1.27 N#CC(=O)/C=C/C1=CC=CC=C1 MCULE-3470946498 [0,1,0,0,0,1|1,0,1]=4 575 B12R1.27 NNC(=O)C=CC1=CC=CC=C1 MCULE-3366212941 [0,1,0,0,0,1|2,0,0]=4 576 B12R1.27 NNC(=O)C=CC1=CC=CN=C1 MCULE-9721752985 [0,1,0,0,0,1|2,0,0]=4 577 B12R1.27 O=C(C=CC1=CC=CC=C1)NO MCULE-6631204989 [0,1,0,0,0,1|2,0,0]=4 578 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-2320385089 [0,1,0,0,0,1|2,0,0]=4 579 B12R1.43 C/C(=C\C1=CC=CC=N1)/C(=O)O MCULE-7937709933 [0,1,0,0,0,1|2,0,0]=4 580 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)Cl MCULE-2710676961 [0,1,0,0,0,1|2,0,0]=4 581 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)O MCULE-9237421946 [0,1,0,0,0,1|2,0,0]=4 582 B12R1.43 CC(=CC1=CC=NC=C1)C(=O)O MCULE-4497311492 [0,1,0,0,0,1|2,0,0]=4 583 B12R1.43 CC(=CC1=CC=NC=C1)C(=O)O MCULE-9348219643 [0,1,0,0,0,1|2,0,0]=4 584 B12R1.43 CC(=CC1=CN=CC=C1)C(=O)O MCULE-3384877642 [0,1,0,0,0,1|2,0,0]=4 585 B12R1.43 CC(=CC1=CN=CC=C1)C(=O)O MCULE-7592730750 [0,1,0,0,0,1|2,0,0]=4 586 B12R1.43 CC(=CC1=NC=CC=C1)C(=O)N MCULE-5204453044 [0,1,0,0,0,1|2,0,0]=4 587 B12R1.43 CC(=CC1=NC=CC=C1)C(=O)O MCULE-1302740145 [0,1,0,0,0,1|2,0,0]=4 588 B12R1.43 CC(=CC1=NC=CC=C1)C(=O)O MCULE-2513369896 [0,1,0,0,0,1|2,0,0]=4 589 B12R1.43 CC(=O)C(=CC1=CC=CC=C1)C MCULE-3659200622 [0,1,0,0,0,1|1,0,0]=3 590 B12R1.43 CC(=O)C(=O)NC1=CC=CC=C1 MCULE-8022797415 [0,1,0,0,0,1|2,0,0]=4 591 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/Cl MCULE-5967816434 [0,1,0,0,0,1|2,0,0]=4 592 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/F MCULE-1278212404 [0,1,0,0,0,1|2,0,0]=4 593 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/O MCULE-9639825195 [0,1,0,0,0,1|2,0,0]=4 594 B12R1.43 O=C(O)/C(=C/C1=CC=CN=C1)/F MCULE-3005239361 [0,1,0,0,0,1|2,0,0]=4 595 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)Cl MCULE-1012118487 [0,1,0,0,0,1|2,0,0]=4 596 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)F MCULE-5587932542 [0,1,0,0,0,1|2,0,0]=4 597 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)O MCULE-9904864252 [0,1,0,0,0,1|2,0,0]=4 598 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)S MCULE-7966134349 [0,1,0,0,0,1|2,0,0]=4 599 B12R1.43 O=C(O)C(=CC1=CC=CN=C1)S MCULE-9764587748 [0,1,0,0,0,1|2,0,0]=4 600 B12R1.43 O=C(O)C(=CC1=CN=CC=C1)F MCULE-3500064918 [0,1,0,0,0,1|2,0,0]=4 601 B12R1.43 O=C(O)C(=CC1=CN=CC=C1)F MCULE-5834768457 [0,1,0,0,0,1|2,0,0]=4 602 B12R1.107 C/C(=C\C(=O)Cl)/C1=CC=CC=C1 MCULE-9852832506 [0,1,0,0,0,1|2,0,0]=4 603 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 MCULE-7874888021 [0,1,0,0,0,1|2,0,0]=4 604 B12R1.107 C=C(NC(=O)C)C1=CC=CC=C1 MCULE-1985628354 [0,1,0,0,0,1|2,0,0]=4 605 B12R1.107 C=C(OC(=O)C)C1=CC=CC=C1 MCULE-4064749340 [0,1,0,0,0,1|2,0,0]=4 606 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)C MCULE-7053628107 [0,1,0,0,0,1|2,0,0]=4 607 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)N MCULE-7047297092 [0,1,0,0,0,1|2,0,0]=4 608 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)O MCULE-6103512840 [0,1,0,0,0,1|1,0,1]=4 609 B12R1.107 CC(=CC(=O)C1=NC=CC=C1)N MCULE-8586954538 [0,1,0,0,0,1|2,0,0]=4 610 B12R1.107 CC(=CC(=O)Cl)C1=CC=CC=C1 MCULE-4373125727 [0,1,0,0,0,1|2,0,0]=4 611 B12R1.107 CC(=CC(=O)O)C1=CC=CC=C1 MCULE-4290555990 [0,1,0,0,0,1|2,0,0]=4 612 B12R1.107 CC(=CC(=O)O)C1=CN=CC=C1 MCULE-6378178409 [0,1,0,0,0,1|2,0,0]=4 613 B12R1.107 CC(=O)C=C(N)C1=CC=CC=C1 MCULE-8012328953 [0,1,0,0,0,1|1,0,0]=3 614 B12R1.107 CC(=O)C=C(O)C1=CC=CC=N1 MCULE-2468013070 [0,1,0,0,0,1|1,0,0]=3 615 B12R1.107 CC(=O)C=C([OH2+])C1=CC=CC=C1 MCULE-1204115903 [0,1,0,0,0,1|1,0,0]=3 616 B12R1.107 CC(=O)C=C([OH2+])C1=CC=CC=C1 MCULE-4267278881 [0,1,0,0,0,1|1,0,0]=3 617 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 MCULE-5543155182 [0,1,0,0,0,1|1,0,1]=4 618 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 MCULE-4723608816 [0,1,0,0,0,1|1,0,1]=4 619 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 MCULE-6196692809 [0,1,0,0,0,1|1,0,1]=4 620 B12R1.107 CC(=O)CC(=O)C1=NC=CC=C1 MCULE-6250336922 [0,1,0,0,0,1|1,0,1]=4 621 B12R1.107 CC(=O)CC(=O)C1=NC=CN=C1 MCULE-3736951815 [0,1,0,0,0,1|1,0,1]=4 622 B12R1.107 CC(=O)NC(=O)C1=NC=CN=C1 MCULE-6076108705 [0,1,0,0,0,1|2,0,0]=4 623 B12R1.125 CC(=O)/C=C/C1=C(C=CC=C1)O MCULE-1868506557 [0,1,0,0,0,1|1,0,0]=3 624 B12R1.125 CC(=O)/C=C/C1=CC=CC=C1Cl MCULE-8236771911 [0,1,0,0,0,1|1,0,0]=3 625 B12R1.125 CC(=O)/C=C/C1=CC=CC=C1F MCULE-9468205773 [0,1,0,0,0,1|1,0,0]=3 626 B12R1.125 CC(=O)C=CC1=C(C=CC=C1)F MCULE-8723109907 [0,1,0,0,0,1|1,0,0]=3 627 B12R1.125 CC(=O)C=CC1=C(C=CC=C1)O MCULE-7363785356 [0,1,0,0,0,1|1,0,0]=3 628 B12R1.125 CC(=O)C=CC1=CC=CC=C1Cl MCULE-4806232592 [0,1,0,0,0,1|1,0,0]=3 629 B12R1.125 CC(=O)C=CC1=CC=CC=[N+]1C MCULE-4256319648 [0,1,0,0,0,1|1,0,0]=3 630 B12R1.125 CC(=O)C=CC1=CC=CC=[N+]1C MCULE-4475357857 [0,1,0,0,0,1|1,0,0]=3 631 B12R1.125 CC1=C(C=CC=C1)C=CC(=O)N MCULE-6358361236 [0,1,0,0,0,1|2,0,0]=4 632 B12R1.125 CC1=C(C=NC=C1)C=CC(=O)O MCULE-1492169042 [0,1,0,0,0,1|2,0,0]=4 633 B12R1.125 CC1=C(C=NC=C1)C=CC(=O)O MCULE-5135224370 [0,1,0,0,0,1|2,0,0]=4 634 B12R1.125 CC1=C(N=CC=C1)C=CC(=O)O MCULE-2497119427 [0,1,0,0,0,1|2,0,0]=4 635 B12R1.125 CC1=C(N=CC=C1)C=CC(=O)O MCULE-3158859403 [0,1,0,0,0,1|2,0,0]=4 636 B12R1.125 CC1=CC=CC=C1/C=C/C(=O)Cl MCULE-9226637615 [0,1,0,0,0,1|2,0,0]=4 637 B12R1.125 CC1=CC=CC=C1/C=C/C(=O)O MCULE-4568393226 [0,1,0,0,0,1|2,0,0]=4 638 B12R1.125 CC1=CC=CC=C1C=CC(=O)Cl MCULE-4237925880 [0,1,0,0,0,1|2,0,0]=4 639 B12R1.125 CC1=CC=CC=C1C=CC(=O)O MCULE-7568109044 [0,1,0,0,0,1|2,0,0]=4 640 B12R1.125 CC1=NC=CC=C1/C=C/C(=O)O MCULE-4255573583 [0,1,0,0,0,1|2,0,0]=4 641 B12R1.125 NC(=O)C=CC1=CC=CC=C1F MCULE-2172697582 [0,1,0,0,0,1|2,0,0]=4 642 B12R1.125 NC1=C(C=CC=C1)C=CC(=O)O MCULE-1813623710 [0,1,0,0,0,1|2,0,0]=4 643 B12R1.125 NC1=C(C=CC=N1)C=CC(=O)O MCULE-2950226173 [0,1,0,0,0,1|2,0,0]=4 644 B12R1.125 NC1=CC=NC=C1C=CC(=O)O MCULE-4130517568 [0,1,0,0,0,1|2,0,0]=4 645 B12R1.125 NC1=NC=CC=C1/C=C/C(=O)O MCULE-3009837322 [0,1,0,0,0,1|2,0,0]=4 646 B12R1.125 O=C(Cl)/C=C/C1=CC=CC=C1Br MCULE-3422484205 [0,1,0,0,0,1|2,0,0]=4 647 B12R1.125 O=C(Cl)/C=C/C1=CC=CC=C1Cl MCULE-7361464496 [0,1,0,0,0,1|2,0,0]=4 648 B12R1.125 O=C(Cl)/C=C/C1=CC=CC=C1F MCULE-1295850260 [0,1,0,0,0,1|2,0,0]=4 649 B12R1.125 O=C(Cl)C=CC1=CC=CC=C1Br MCULE-4696622547 [0,1,0,0,0,1|2,0,0]=4 650 B12R1.125 O=C(Cl)C=CC1=CC=CC=C1Cl MCULE-6059726442 [0,1,0,0,0,1|2,0,0]=4 651 B12R1.125 O=C(Cl)C=CC1=CC=CC=C1F MCULE-1613831825 [0,1,0,0,0,1|2,0,0]=4 652 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br MCULE-9715214740 [0,1,0,0,0,1|2,0,0]=4 653 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F MCULE-5550079587 [0,1,0,0,0,1|2,0,0]=4 654 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)O MCULE-5451854573 [0,1,0,0,0,1|2,0,0]=4 655 B12R1.125 O=C(O)/C=C/C1=C(C=NC=C1)F MCULE-4119074797 [0,1,0,0,0,1|2,0,0]=4 656 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1Cl MCULE-6586897772 [0,1,0,0,0,1|2,0,0]=4 657 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1I MCULE-4367628203 [0,1,0,0,0,1|2,0,0]=4 658 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)Br MCULE-1992481262 [0,1,0,0,0,1|2,0,0]=4 659 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)F MCULE-2337664175 [0,1,0,0,0,1|2,0,0]=4 660 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)I MCULE-8228854548 [0,1,0,0,0,1|2,0,0]=4 661 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)O MCULE-7485332494 [0,1,0,0,0,1|2,0,0]=4 662 B12R1.125 O=C(O)C=CC1=C(C=NC=C1)F MCULE-2071172197 [0,1,0,0,0,1|2,0,0]=4 663 B12R1.125 O=C(O)C=CC1=CC=CC=C1Cl MCULE-7865645572 [0,1,0,0,0,1|2,0,0]=4 664 B12R1.226 C(=CC1=CC(=CC=C1)I)C(=O)N MCULE-4176762531 [0,1,0,0,0,1|2,0,0]=4 665 B12R1.226 CC(=O)/C=C/C1=CC=CC(=C1)Br MCULE-8108539402 [0,1,0,0,0,1|1,0,0]=3 666 B12R1.226 CC(=O)/C=C/C1=CC=CC(=C1)Cl MCULE-8037927417 [0,1,0,0,0,1|1,0,0]=3 667 B12R1.226 CC(=O)/C=C/C1=NC(=CC=C1)Br MCULE-1311369874 [0,1,0,0,0,1|1,0,0]=3 668 B12R1.226 CC(=O)C=CC1=CC(=CC=C1)Br MCULE-5033330246 [0,1,0,0,0,1|1,0,0]=3 669 B12R1.226 CC(=O)C=CC1=CC(=CC=C1)O MCULE-9256997153 [0,1,0,0,0,1|1,0,0]=3 670 B12R1.226 CC(=O)C=CC1=CC=CC(=C1)Cl MCULE-1900827492 [0,1,0,0,0,1|1,0,0]=3 671 B12R1.226 CC(=O)C=CC1=CC=C[N+](=C1)C MCULE-8144877712 [0,1,0,0,0,1|1,0,0]=3 672 B12R1.226 CC(=O)C=CC1=CC=C[N+](=C1)C MCULE-8869559460 [0,1,0,0,0,1|1,0,0]=3 673 B12R1.226 CC1=CC(=CC=C1)C=CC(=O)Cl MCULE-8246010149 [0,1,0,0,0,1|2,0,0]=4 674 B12R1.226 CC1=CC(=CC=N1)/C=C/C(=O)O MCULE-3248263659 [0,1,0,0,0,1|2,0,0]=4 675 B12R1.226 CC1=CC=CC(=C1)/C=C/C(=O)O MCULE-8374932634 [0,1,0,0,0,1|2,0,0]=4 676 B12R1.226 CC1=CC=CC(=C1)C=CC(=O)O MCULE-3959203742 [0,1,0,0,0,1|2,0,0]=4 677 B12R1.226 CC1=CC=CC(=N1)/C=C/C(=O)O MCULE-2040763678 [0,1,0,0,0,1|2,0,0]=4 678 B12R1.226 CC1=CC=CC(=N1)/C=C\C(=O)O MCULE-4639232836 [0,1,0,0,0,1|2,0,0]=4 679 B12R1.226 CC1=CC=CC(=N1)C=CC(=O)O MCULE-6333063225 [0,1,0,0,0,1|2,0,0]=4 680 B12R1.226 NC(=O)C=CC1=CC(=CC=C1)Br MCULE-9316167879 [0,1,0,0,0,1|2,0,0]=4 681 B12R1.226 NC(=O)C=CC1=CC(=CC=C1)F MCULE-5756808409 [0,1,0,0,0,1|2,0,0]=4 682 B12R1.226 NC1=CC(=CC=C1)/C=C/C(=O)O MCULE-7167283449 [0,1,0,0,0,1|2,0,0]=4 683 B12R1.226 NC1=CC(=CC=C1)C=CC(=O)O MCULE-5453082320 [0,1,0,0,0,1|2,0,0]=4 684 B12R1.226 O=C(Cl)/C=C/C1=CC(=CC=C1)F MCULE-7094115876 [0,1,0,0,0,1|2,0,0]=4 685 B12R1.226 O=C(Cl)/C=C/C1=CC=CC(=C1)Cl MCULE-9473663135 [0,1,0,0,0,1|2,0,0]=4 686 B12R1.226 O=C(Cl)C=CC1=CC=CC(=C1)Cl MCULE-6909064780 [0,1,0,0,0,1|2,0,0]=4 687 B12R1.226 O=C(Cl)C=CC1=CC=CC(=C1)F MCULE-6306653090 [0,1,0,0,0,1|2,0,0]=4 688 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Cl MCULE-1720842356 [0,1,0,0,0,1|2,0,0]=4 689 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)F MCULE-2603258292 [0,1,0,0,0,1|2,0,0]=4 690 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)I MCULE-9847298098 [0,1,0,0,0,1|2,0,0]=4 691 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O MCULE-5006038728 [0,1,0,0,0,1|2,0,0]=4 692 B12R1.226 O=C(O)/C=C/C1=CC=CC(=C1)Br MCULE-4180809927 [0,1,0,0,0,1|2,0,0]=4 693 B12R1.226 O=C(O)/C=C\C1=CC(=NC=C1)Cl MCULE-3955229529 [0,1,0,0,0,1|2,0,0]=4 694 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)Cl MCULE-5483586899 [0,1,0,0,0,1|2,0,0]=4 695 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)I MCULE-7006843197 [0,1,0,0,0,1|2,0,0]=4 696 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)O MCULE-2569094851 [0,1,0,0,0,1|2,0,0]=4 697 B12R1.226 O=C(O)C=CC1=CC(=CN=C1)F MCULE-9122757719 [0,1,0,0,0,1|2,0,0]=4 698 B12R1.226 O=C(O)C=CC1=CC(=NC=C1)Cl MCULE-8435129146 [0,1,0,0,0,1|2,0,0]=4 699 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)Br MCULE-1630202729 [0,1,0,0,0,1|2,0,0]=4 700 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)F MCULE-6918071243 [0,1,0,0,0,1|2,0,0]=4 701 B12R1.226 O=C(O)C=CC1=CC=CC(=N1)Br MCULE-2180401449 [0,1,0,0,0,1|2,0,0]=4 702 B12R1.891 CP(=O)(C)C=CC1=CC=CC=C1 MCULE-5098936456 [0,1,0,0,0,1|2,0,0]=4 703 B12R1.891 CS(=O)(=O)C=CC1=CC=CC=C1 MCULE-7231902956 [0,1,0,0,0,1|2,0,0]=4 704 B12R1.54 CC(=NNC(=O)C1=CC=CO1)C MCULE-3185221906 [0,1,0,0,0,1|2,0,0]=4 705 B12R1.54 CC(=NNC(=O)N)C1=CC=CO1 MCULE-1089910487 [0,1,0,0,0,1|2,0,0]=4 706 B12R1.54 CC(=O)CCC(=O)C1=CC=CO1 MCULE-6143224711 [0,1,0,0,0,1|0,0,1]=3 707 B12R1.54 CC(=O)CCC(=O)C1=CC=CS1 MCULE-7592855571 [0,1,0,0,0,1|0,1,1]=4 708 B12R1.54 CC(=O)OCC(=O)C1=CC=CO1 MCULE-6619266698 [0,1,0,0,0,1|0,0,1]=3 709 B12R1.54 CC(=O)OCC(=O)C1=CC=CS1 MCULE-1281602021 [0,1,0,0,0,1|0,1,1]=4 710 B12R1.54 CN(C)/C=C/C(=O)C1=CC=CO1 MCULE-9040287212 [0,1,0,0,0,1|2,0,0]=4 711 B12R1.54 CN(C)/C=N/C(=O)C1=CC=CO1 MCULE-8092842414 [0,1,0,0,0,1|2,0,0]=4 712 B12R1.54 CN(C)C=CC(=O)C1=CC=CO1 MCULE-8742894295 [0,1,0,0,0,1|2,0,0]=4 713 B12R1.54 CN(C)C=NC(=O)C1=CC=CO1 MCULE-1741615618 [0,1,0,0,0,1|2,0,0]=4 714 B12R1.54 O=C(O)C=CC(=O)C1=CC=CS1 MCULE-2390407235 [0,1,0,0,0,1|1,1,0]=4 715 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 MCULE-3985171621 [0,1,0,0,0,1|1,0,1]=4 716 B12R1.54 O=C(O)CNC(=O)C1=CC=CO1 MCULE-2987926118 [0,1,0,0,0,1|1,0,1]=4 717 B12R1.105 CC(=O)NN=CC1=CC=C(S1)Br MCULE-6449891840 [0,1,0,0,0,1|1,1,0]=4 718 B12R1.105 CC1=CC=C(O1)/C=N/NC(=O)N MCULE-7299300798 [0,1,0,0,0,1|2,0,0]=4 719 B12R1.105 CC1=CC=C(O1)C=NNC(=O)N MCULE-4210091517 [0,1,0,0,0,1|2,0,0]=4 720 B12R1.105 NC(=O)NN=CC1=CC=C(O1)N MCULE-5215830282 [0,1,0,0,0,1|2,0,0]=4 721 B12R1.264 C=C(C)C(=O)OCC1=CC=CO1 MCULE-2705092200 [0,1,0,0,0,1|1,0,1]=4 722 B12R1.264 CN(C)C(=O)C=CC1=CC=CO1 MCULE-6322889365 [0,1,0,0,0,1|2,0,0]=4 723 B12R1.264 O=C(O)C(=O)C=CC1=CC=CO1 MCULE-1023996256 [0,1,0,0,0,1|1,0,0]=3 724 B12R1.264 O=C(O)C(=O)C=CC1=CC=CS1 MCULE-3493980124 [0,1,0,0,0,1|1,1,0]=4 725 B12R1.264 O=C([O-])C(=O)C=CC1=CC=CO1 MCULE-3126167037 [0,1,0,0,0,1|1,0,0]=3 726 B12R1.477 CNC(=O)NC=CC1=CC=CO1 MCULE-9730401362 [0,1,0,0,0,1|0,0,0]=2 727 B12R1.477 CNC(=S)NN=CC1=CC=CO1 MCULE-5578379629 [0,1,0,0,0,1|1,1,0]=4 728 B12R1.477 COC(=O)CNCC1=CC=CO1 MCULE-5205560770 [0,1,0,0,0,1|0,0,2]=4 729 B12R1.477 COC(=O)CSCC1=CC=CO1 MCULE-9164054977 [0,1,0,0,0,1|0,0,2]=4 730 B12R1.477 COC(=O)NN=CC1=CC=CN1 MCULE-9978187309 [0,1,0,0,0,1|2,0,0]=4 731 B12R1.477 COC(=O)NN=CC1=CC=CS1 MCULE-1026700904 [0,1,0,0,0,1|1,1,0]=4 732 B12R1.477 CSC(=O)NN=CC1=CC=CO1 MCULE-2277950786 [0,1,0,0,0,1|1,0,0]=3 733 B12R1.477 CSC(=O)NN=CC1=CC=CS1 MCULE-3696665259 [0,1,0,0,0,1|1,1,0]=4 734 B12R1.477 CSC(=S)NN=CC1=CC=CO1 MCULE-7617523456 [0,1,0,0,0,1|1,1,0]=4 735 B12R1.477 O=C(CO)NN=CC1=CC=CO1 MCULE-2887065164 [0,1,0,0,0,1|1,0,0]=3 736 B12R1.477 O=C(CO)NN=CC1=CC=CS1 MCULE-4967472019 [0,1,0,0,0,1|1,1,0]=4 737 B12R1.890 CS(=O)(=O)NN=CC1=CC=CO1 MCULE-3058970755 [0,1,0,0,0,1|2,0,0]=4 738 B12R1.15 CC(NC(=O)CCl)C1=CC=CO1 MCULE-7839604461 [0,2,0,0,0,0|1,0,1]=4 739 B12R1.15 COC(=O)CC(=O)C1=CC=CO1 MCULE-9245629328 [0,2,0,0,0,0|0,0,1]=3 740 B12R1.15 COC(=O)CC(=O)C1=CC=CS1 MCULE-3785477237 [0,2,0,0,0,0|0,1,1]=4 741 B12R1.15 COC(=O)CC(N)C1=CC=CO1 MCULE-7381031265 [0,2,0,0,0,0|0,0,2]=4 742 B12R1.15 COC(=O)CC(N)C1=CC=CO1 MCULE-8131386004 [0,2,0,0,0,0|0,0,2]=4 743 B12R1.15 COC(=O)C[C@@H](N)C1=CC=CO1 MCULE-2671802349 [0,2,0,0,0,0|0,0,2]=4 744 B12R1.15 COC(=O)C[C@@H](N)C1=CC=CO1 MCULE-2983258408 [0,2,0,0,0,0|0,0,2]=4 745 B12R1.15 COC(=O)C[C@H](N)C1=CC=CO1 MCULE-5962138330 [0,2,0,0,0,0|0,0,2]=4 746 B12R1.15 COC(=O)C[C@H](N)C1=CC=CO1 MCULE-7933752993 [0,2,0,0,0,0|0,0,2]=4 747 B12R1.15 O=C(CCl)NC(=O)C1=CC=CN1 MCULE-3424634881 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.15 O=C(CCl)NC(=O)C1=CC=CO1 MCULE-2758534721 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.15 O=C(CCl)NC(=O)C1=CC=CS1 MCULE-3540483785 [0,2,0,0,0,0|1,1,0]=4 750 B12R1.26 COC(=O)/C=C/C1=CC(=CS1)Br MCULE-8329797896 [0,2,0,0,0,0|0,1,0]=3 751 B12R1.26 COC(=O)/C=C/C1=CC=C(S1)Br MCULE-4409915901 [0,2,0,0,0,0|0,1,0]=3 752 B12R1.26 COC(=O)/C=C/C1=CN=C(N1)C MCULE-9836197492 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.26 COC(=O)C=CC1=CC(=CS1)Br MCULE-7679308026 [0,2,0,0,0,0|0,1,0]=3 754 B12R1.26 COC(=O)C=CC1=CC=C(O1)Br MCULE-2606508894 [0,2,0,0,0,0|0,0,0]=2 755 B12R1.51 CCNC(=O)NCC1=CC=CO1 MCULE-6559693536 [0,2,0,0,0,0|1,0,1]=4 756 B12R1.51 CCOC(=O)/C=C/C1=CC=CN1 MCULE-5834777761 [0,2,0,0,0,0|1,0,0]=3 757 B12R1.51 CCOC(=O)/C=C/C1=CC=CO1 MCULE-7171775414 [0,2,0,0,0,0|0,0,0]=2 758 B12R1.51 CCOC(=O)/C=C/C1=CC=CS1 MCULE-5761265420 [0,2,0,0,0,0|0,1,0]=3 759 B12R1.51 CCOC(=O)/C=C/C1=CN=CS1 MCULE-5660176529 [0,2,0,0,0,0|1,1,0]=4 760 B12R1.51 CCOC(=O)/C=C/C1=CSC=C1 MCULE-1935777312 [0,2,0,0,0,0|2,0,0]=4 761 B12R1.51 CCOC(=O)/C=C/C1=CSC=N1 MCULE-3079678503 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.51 CCOC(=O)C=CC1=CC=CO1 MCULE-9891032976 [0,2,0,0,0,0|0,0,0]=2 763 B12R1.51 CCOC(=O)C=CC1=CC=CS1 MCULE-4827683535 [0,2,0,0,0,0|0,1,0]=3 764 B12R1.51 CCOC(=O)C=CC1=CN=CS1 MCULE-2056729826 [0,2,0,0,0,0|1,1,0]=4 765 B12R1.51 CCOC(=O)C=CC1=CNC=N1 MCULE-6417473993 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.51 CCOC(=O)C=CC1=CSC=C1 MCULE-1037834889 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.51 CCOC(=O)C=CC1=CSC=N1 MCULE-5732378649 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.51 CCOC(=O)CCC1=CC=CO1 MCULE-5340258921 [0,2,0,0,0,0|0,0,2]=4 769 B12R1.51 CNCC(=O)NCC1=CC=CO1 MCULE-6693081414 [0,2,0,0,0,0|1,0,1]=4 770 B12R1.51 CNCC(=O)NCC1=CC=CO1 MCULE-8188098584 [0,2,0,0,0,0|1,0,1]=4 771 B12R1.51 N#CCC(=O)NCC1=CC=CO1 MCULE-2709416470 [0,2,0,0,0,0|1,0,1]=4 772 B12R1.51 NCCC(=O)NCC1=CC=CO1 MCULE-3975764461 [0,2,0,0,0,0|1,0,1]=4 773 B12R1.51 NCCC(=O)NCC1=CC=CO1 MCULE-8814124885 [0,2,0,0,0,0|1,0,1]=4 774 B12R1.51 O=C(CCCl)NCC1=CC=CO1 MCULE-5813534472 [0,2,0,0,0,0|1,0,1]=4 775 B12R1.51 [N-]=[N+]=NC(=O)C=CC1=CC=CO1 MCULE-5162031491 [0,2,0,0,0,0|1,0,0]=3 776 B12R1.108 CN(CC1=CC=CO1)C(=O)CCl MCULE-8288876812 [0,2,0,0,0,0|1,0,1]=4 777 B12R1.108 CN(CC1=CC=CO1)C(=O)CN MCULE-5105467490 [0,2,0,0,0,0|1,0,1]=4 778 B12R1.108 COC(=O)C(=CC1=CC=CS1)O MCULE-2678751476 [0,2,0,0,0,0|0,1,0]=3 779 B12R1.108 COC(=O)C(N)CC1=CC=CO1 MCULE-7425094178 [0,2,0,0,0,0|0,0,2]=4 780 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-4575656185 [0,2,0,0,0,0|0,0,2]=4 781 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-7970765227 [0,2,0,0,0,0|0,0,2]=4 782 B12R1.353 COC(=O)/C=C/C1=CC=NN1C MCULE-9707789024 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.353 COC(=O)C=CC1=CC=NN1C MCULE-1806158152 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.104 CC(=CC1=CC=C(O1)Br)C(=O)O MCULE-9577832792 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.104 CC1=CC=C(O1)/C=C(/C)\C(=O)O MCULE-4381782949 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.104 O=[N+]([O-])C(=CC1=CC=C(O1)Br)Br MCULE-9333853274 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.298 C(=C(C#N)C(=O)C)C1=CC=CS1 MCULE-3130218157 [0,2,0,0,0,0|0,1,0]=3 788 B12R1.298 CC(=O)C(=CC1=COC=C1)C#N MCULE-8067290765 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.298 CC(=O)C(=CC1=CSC=C1)C#N MCULE-4344431420 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.298 N#C/C(=C/C1=CC=CN1)/C(=O)O MCULE-2685824406 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.298 N#C/C(=C/C1=CC=CO1)/C(=O)O MCULE-8066559531 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.298 N#C/C(=C\C1=CC=CS1)/C(=O)N MCULE-3077400193 [0,2,0,0,0,0|1,1,0]=4 793 B12R1.298 N#C/C(=C\C1=CC=CS1)/C(=O)O MCULE-1318138263 [0,2,0,0,0,0|1,1,0]=4 794 B12R1.298 N#CC(=CC1=CC=CN1)C(=O)O MCULE-5016646146 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.298 N#CC(=CC1=CC=CO1)C(=O)N MCULE-7337871514 [0,2,0,0,0,0|1,0,0]=3 796 B12R1.298 N#CC(=CC1=CC=CO1)C(=O)O MCULE-2529264063 [0,2,0,0,0,0|1,0,0]=3 797 B12R1.298 N#CC(=CC1=CC=CO1)C(=S)N MCULE-3733970569 [0,2,0,0,0,0|1,1,0]=4 798 B12R1.298 N#CC(=CC1=CC=CS1)C(=O)N MCULE-4105370902 [0,2,0,0,0,0|1,1,0]=4 799 B12R1.298 N#CC(=CC1=CC=CS1)C(=O)O MCULE-9274500443 [0,2,0,0,0,0|1,1,0]=4 800 B12R1.59 CC(=O)OCC1=CC=C(O1)C=O MCULE-2382269887 [0,2,0,0,0,0|1,0,1]=4 801 B12R1.59 CCC1=CC=C(O1)C=CC(=O)O MCULE-7329795598 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.59 CCC1=CC=C(S1)C=CC(=O)O MCULE-2899393363 [0,2,0,0,0,0|1,1,0]=4 803 B12R1.59 CSC1=CC=C(S1)C=CC(=O)O MCULE-4751959713 [0,2,0,0,0,0|1,1,0]=4 804 B12R1.59 O=C(O)C=CC1=CC(=CS1)CO MCULE-6318769358 [0,2,0,0,0,0|1,1,0]=4 805 B12R1.103 CC(=CC(=O)C1=CC(=CS1)Br)C MCULE-5454234412 [0,2,0,0,0,0|1,1,0]=4 806 B12R1.103 CC(=CC(=O)C1=CC=C(S1)Br)C MCULE-2849459942 [0,2,0,0,0,0|1,1,0]=4 807 B12R1.103 CC(=CC(=O)C1=CC=C(S1)C)C MCULE-5146527910 [0,2,0,0,0,0|1,1,0]=4 808 B12R1.103 CC(=CC(=O)C1=CC=C(S1)Cl)C MCULE-8383584406 [0,2,0,0,0,0|1,1,0]=4 809 B12R1.103 CC(=O)CC(=O)C1=CC=C(S1)Br MCULE-2105656866 [0,2,0,0,0,0|0,1,1]=4 810 B12R1.110 O=[N+]([O-])C=CC1=CC(=C(O1)Br)Br MCULE-9399533028 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.870 CC(=O)C=CC1=CSC(=C1Br)Br MCULE-2473169778 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.144 CC(=CC(=O)C1=C(C=CO1)C)C MCULE-7029794585 [0,2,0,0,0,0|1,0,0]=3 813 B12R1.144 CC(=CC(=O)C1=C(C=CS1)Br)C MCULE-4324799606 [0,2,0,0,0,0|1,1,0]=4 814 B12R1.144 CC(=CC(=O)C1=C(C=CS1)C)C MCULE-5448837427 [0,2,0,0,0,0|1,1,0]=4 815 B12R1.476 CC(=O)OC(C#N)C1=CC=CO1 MCULE-9981261571 [0,2,0,0,0,0|1,0,1]=4 816 B12R1.476 N#C/C(=C/C(=O)[O-])/C1=CC=CS1 MCULE-1566835785 [0,2,0,0,0,0|1,1,0]=4 817 B12R1.476 N#C/C(=C/C(=O)[O-])/C1=CC=CS1 MCULE-3531386788 [0,2,0,0,0,0|1,1,0]=4 818 B12R1.476 N#CC(=CC(=O)[O-])C1=CC=CS1 MCULE-4054258843 [0,2,0,0,0,0|1,1,0]=4 819 B12R1.476 N#CC(=CC(=O)[O-])C1=CC=CS1 MCULE-8896624760 [0,2,0,0,0,0|1,1,0]=4 820 B10R1.10 CC1=CC(=CC=C1)C=NO MCULE-5958537698 [0,0,1,1,0,0|2,0,0]=4 821 B10R1.10 CC1=CC=CC(=N1)C=NO MCULE-5604427983 [0,0,1,1,0,0|2,0,0]=4 822 B10R1.10 CC1=NC(=CC=C1)/C=N/O MCULE-2128229434 [0,0,1,1,0,0|2,0,0]=4 823 B10R1.18 CC(=CC1=CC=CC=C1)C MCULE-2348884024 [0,0,1,1,0,0|2,0,0]=4 824 B10R1.18 CC(=O)CC1=CC=CC=C1 MCULE-2102027204 [0,0,1,1,0,0|1,0,1]=4 825 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-4376271458 [0,0,1,1,0,0|1,0,1]=4 826 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-6272069358 [0,0,1,1,0,0|1,0,1]=4 827 B10R1.18 CC(=O)CC1=NC=CC=C1 MCULE-6150090454 [0,0,1,1,0,0|1,0,1]=4 828 B10R1.18 CC(=O)NC1=CC=CC=C1 MCULE-1268638727 [0,0,1,1,0,0|2,0,0]=4 829 B10R1.18 CC(=O)NC1=CC=CN=C1 MCULE-5150981925 [0,0,1,1,0,0|2,0,0]=4 830 B10R1.18 CC(=O)NC1=NC=CC=C1 MCULE-5836577741 [0,0,1,1,0,0|2,0,0]=4 831 B10R1.18 CC(=O)OC1=CC=CC=C1 MCULE-3760278339 [0,0,1,1,0,0|2,0,0]=4 832 B10R1.18 CC(=O)OC1=CC=CC=C1 MCULE-9633533770 [0,0,1,1,0,0|2,0,0]=4 833 B10R1.18 CC(=O)OC1=CC=CN=C1 MCULE-6451249272 [0,0,1,1,0,0|2,0,0]=4 834 B10R1.18 CC(=O)SC1=CC=CC=C1 MCULE-5781494641 [0,0,1,1,0,0|2,0,0]=4 835 B10R1.39 O=CC1=C(C=CO1)C(=O)O MCULE-6471557174 [0,0,1,1,0,0|2,0,0]=4 836 B10R1.61 C=C(C)C1=C(C=CC=C1)Br MCULE-5430389657 [0,0,1,1,0,0|2,0,0]=4 837 B10R1.61 C=C(C)C1=C(C=CC=C1)F MCULE-4684194628 [0,0,1,1,0,0|2,0,0]=4 838 B10R1.61 C=C(C)C1=CC=CC=C1C MCULE-1262596014 [0,0,1,1,0,0|2,0,0]=4 839 B10R1.61 C=C(C)C1=CC=CC=C1N MCULE-8879679032 [0,0,1,1,0,0|2,0,0]=4 840 B10R1.61 CC(=O)C1=C(C=CC=C1)Br MCULE-1424693990 [0,0,1,1,0,0|1,0,0]=3 841 B10R1.61 CC(=O)C1=C(C=CC=C1)C MCULE-1749200131 [0,0,1,1,0,0|1,0,0]=3 842 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl MCULE-2144222308 [0,0,1,1,0,0|1,0,0]=3 843 B10R1.61 CC(=O)C1=C(C=CC=C1)F MCULE-8613480392 [0,0,1,1,0,0|1,0,0]=3 844 B10R1.61 CC(=O)C1=C(C=CC=C1)I MCULE-3552316800 [0,0,1,1,0,0|1,0,0]=3 845 B10R1.61 CC(=O)C1=C(C=CC=C1)O MCULE-6901537094 [0,0,1,1,0,0|0,0,0]=2 846 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1786007668 [0,0,1,1,0,0|2,0,0]=4 847 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1864551259 [0,0,1,1,0,0|2,0,0]=4 848 B10R1.61 CC(=O)C1=C(C=CN=C1)Cl MCULE-1860885201 [0,0,1,1,0,0|2,0,0]=4 849 B10R1.61 CC(=O)C1=C(C=CN=C1)Cl MCULE-4326251229 [0,0,1,1,0,0|2,0,0]=4 850 B10R1.61 CC(=O)C1=C(C=CN=C1)F MCULE-2356957788 [0,0,1,1,0,0|2,0,0]=4 851 B10R1.61 CC(=O)C1=C(C=CN=C1)N MCULE-5759723657 [0,0,1,1,0,0|2,0,0]=4 852 B10R1.61 CC(=O)C1=C(C=CN=C1)O MCULE-2666165855 [0,0,1,1,0,0|1,0,0]=3 853 B10R1.61 CC(=O)C1=C(C=NC=C1)Br MCULE-6626151846 [0,0,1,1,0,0|2,0,0]=4 854 B10R1.61 CC(=O)C1=C(C=NC=C1)C MCULE-5320077243 [0,0,1,1,0,0|1,0,1]=4 855 B10R1.61 CC(=O)C1=C(C=NC=C1)Cl MCULE-3091099587 [0,0,1,1,0,0|2,0,0]=4 856 B10R1.61 CC(=O)C1=C(C=NC=C1)F MCULE-7778949077 [0,0,1,1,0,0|2,0,0]=4 857 B10R1.61 CC(=O)C1=C(C=NC=C1)N MCULE-1200285505 [0,0,1,1,0,0|2,0,0]=4 858 B10R1.61 CC(=O)C1=C(C=NC=C1)N MCULE-6637347706 [0,0,1,1,0,0|2,0,0]=4 859 B10R1.61 CC(=O)C1=C(C=NC=C1)O MCULE-9732792007 [0,0,1,1,0,0|1,0,0]=3 860 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl MCULE-8683539263 [0,0,1,1,0,0|2,0,0]=4 861 B10R1.61 CC(=O)C1=C(N=CC=C1)N MCULE-3588289826 [0,0,1,1,0,0|2,0,0]=4 862 B10R1.61 CC(=O)C1=CC=CC=C1N MCULE-2549166565 [0,0,1,1,0,0|1,0,0]=3 863 B10R1.61 CC(=O)C1=CC=CC=C1N MCULE-8977994715 [0,0,1,1,0,0|1,0,0]=3 864 B10R1.61 CC(=O)C1=CC=CC=C1S MCULE-3881664738 [0,0,1,1,0,0|0,1,0]=3 865 B10R1.61 CC(=O)C1=CC=CN=C1Br MCULE-7197475093 [0,0,1,1,0,0|2,0,0]=4 866 B10R1.61 CC(=O)C1=CC=CN=C1C MCULE-6054213950 [0,0,1,1,0,0|2,0,0]=4 867 B10R1.61 CC(=O)C1=CC=CN=C1F MCULE-5772803066 [0,0,1,1,0,0|2,0,0]=4 868 B10R1.61 CC(=O)C1=CC=CNC1=O MCULE-8332051237 [0,0,1,1,0,0|1,0,1]=4 869 B10R1.61 CC(=O)C1=NC=CC=C1Br MCULE-2966393485 [0,0,1,1,0,0|2,0,0]=4 870 B10R1.61 CC(=O)C1=NC=CC=C1C MCULE-7445442229 [0,0,1,1,0,0|2,0,0]=4 871 B10R1.61 CC(=O)C1=NC=CC=C1Cl MCULE-9803438152 [0,0,1,1,0,0|2,0,0]=4 872 B10R1.61 CC(=O)C1=NC=CC=C1F MCULE-7028111083 [0,0,1,1,0,0|2,0,0]=4 873 B10R1.61 CC(=O)C1=NC=CC=C1I MCULE-4894338986 [0,0,1,1,0,0|2,0,0]=4 874 B10R1.61 CC(=O)C1=NC=CC=C1N MCULE-6340439391 [0,0,1,1,0,0|2,0,0]=4 875 B10R1.61 CC(=O)C1=NC=CC=C1N MCULE-8318657374 [0,0,1,1,0,0|2,0,0]=4 876 B10R1.61 CC(=O)C1=NC=CC=C1O MCULE-2705814075 [0,0,1,1,0,0|1,0,0]=3 877 B10R1.61 CC(C)C1=C(C=CC=C1)O MCULE-1601888573 [0,0,1,1,0,0|1,0,1]=4 878 B10R1.61 CC(N)C1=C(C=CC=C1)O MCULE-3525777586 [0,0,1,1,0,0|1,0,1]=4 879 B10R1.61 CC(N)C1=C(C=CC=C1)O MCULE-5813206323 [0,0,1,1,0,0|1,0,1]=4 880 B10R1.61 CC(O)C1=CC=CC=C1O MCULE-4471866924 [0,0,1,1,0,0|0,0,2]=4 881 B10R1.61 CC1=C(C=CC=C1)C(=O)N MCULE-4275866059 [0,0,1,1,0,0|2,0,0]=4 882 B10R1.61 CC1=C(C=CC=C1)C(=O)O MCULE-8662697935 [0,0,1,1,0,0|2,0,0]=4 883 B10R1.61 CC1=CC=CC=C1C(=O)Cl MCULE-4338357930 [0,0,1,1,0,0|2,0,0]=4 884 B10R1.61 CN(C)C1=CC=CC=C1O MCULE-4246356476 [0,0,1,1,0,0|2,0,0]=4 885 B10R1.61 CS(=O)C1=C(C=CC=C1)F MCULE-8906358654 [0,0,1,1,0,0|2,0,0]=4 886 B10R1.61 CS(=O)C1=C(C=CC=C1)O MCULE-4255454592 [0,0,1,1,0,0|1,0,0]=3 887 B10R1.61 CS(=O)C1=CC=CC=C1Br MCULE-8988410069 [0,0,1,1,0,0|2,0,0]=4 888 B10R1.61 CS(=O)C1=CC=CC=C1Cl MCULE-4003113487 [0,0,1,1,0,0|2,0,0]=4 889 B10R1.61 CS(=O)C1=CC=CC=C1I MCULE-5471318039 [0,0,1,1,0,0|2,0,0]=4 890 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)O MCULE-7995139164 [0,0,1,1,0,0|1,0,1]=4 891 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)O MCULE-9576216324 [0,0,1,1,0,0|1,0,1]=4 892 B10R1.61 C[C@@H](N)C1=CC=CC=C1O MCULE-9689056033 [0,0,1,1,0,0|1,0,1]=4 893 B10R1.61 C[C@H](N)C1=C(C=CC=C1)O MCULE-9321514216 [0,0,1,1,0,0|1,0,1]=4 894 B10R1.61 C[C@H](N)C1=CC=CC=C1O MCULE-4301361810 [0,0,1,1,0,0|1,0,1]=4 895 B10R1.61 C[C@H](N)C1=CC=CC=C1O MCULE-9252601943 [0,0,1,1,0,0|1,0,1]=4 896 B10R1.61 N=C(N)C1=C(C=CC=C1)O MCULE-5077898189 [0,0,1,1,0,0|2,0,0]=4 897 B10R1.61 N=C(N)C1=C(C=CC=C1)O MCULE-9455602450 [0,0,1,1,0,0|2,0,0]=4 898 B10R1.61 NC(=O)C1=C(C=CC=C1)Br MCULE-9824828411 [0,0,1,1,0,0|2,0,0]=4 899 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl MCULE-2197159722 [0,0,1,1,0,0|2,0,0]=4 900 B10R1.61 NC(=O)C1=C(C=CC=C1)F MCULE-1888512768 [0,0,1,1,0,0|2,0,0]=4 901 B10R1.61 NC(=O)C1=C(C=CC=C1)O MCULE-5482995635 [0,0,1,1,0,0|1,0,0]=3 902 B10R1.61 NC(=O)C1=C(C=CC=C1)S MCULE-6001730008 [0,0,1,1,0,0|1,1,0]=4 903 B10R1.61 NC(=O)C1=C(C=CC=N1)O MCULE-3212155538 [0,0,1,1,0,0|2,0,0]=4 904 B10R1.61 NC(=O)C1=C(C=CN=C1)O MCULE-3805082690 [0,0,1,1,0,0|2,0,0]=4 905 B10R1.61 NC(=O)C1=CC=CC=C1I MCULE-9927575220 [0,0,1,1,0,0|2,0,0]=4 906 B10R1.61 NC(=O)C1=CC=CC=C1N MCULE-6335935491 [0,0,1,1,0,0|2,0,0]=4 907 B10R1.61 NC(=O)C1=CC=NC=C1O MCULE-4727285160 [0,0,1,1,0,0|2,0,0]=4 908 B10R1.61 NC(=S)C1=C(C=CC=C1)O MCULE-1326205989 [0,0,1,1,0,0|1,1,0]=4 909 B10R1.61 NC1=C(C=CC=C1)C(=O)O MCULE-8970106555 [0,0,1,1,0,0|2,0,0]=4 910 B10R1.61 O=C(Cl)C1=C(C=CC=C1)Br MCULE-1832009044 [0,0,1,1,0,0|2,0,0]=4 911 B10R1.61 O=C(Cl)C1=C(C=CC=C1)F MCULE-7273089296 [0,0,1,1,0,0|2,0,0]=4 912 B10R1.61 O=C(Cl)C1=C(C=CC=C1)I MCULE-2174057030 [0,0,1,1,0,0|2,0,0]=4 913 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl MCULE-8943630978 [0,0,1,1,0,0|2,0,0]=4 914 B10R1.61 O=C(Cl)C1=CC=CC=C1O MCULE-4010403743 [0,0,1,1,0,0|1,0,0]=3 915 B10R1.61 O=C(Cl)C1=CC=CC=C1S MCULE-5048802101 [0,0,1,1,0,0|1,1,0]=4 916 B10R1.61 O=C(Cl)C1=NC=CC=C1O MCULE-3590462423 [0,0,1,1,0,0|2,0,0]=4 917 B10R1.61 O=C(O)C1=C(C=CC=C1)Br MCULE-3239222085 [0,0,1,1,0,0|2,0,0]=4 918 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl MCULE-1696137032 [0,0,1,1,0,0|2,0,0]=4 919 B10R1.61 O=C(O)C1=C(C=CC=C1)O MCULE-4238157211 [0,0,1,1,0,0|1,0,0]=3 920 B10R1.61 O=C(O)C1=C(C=CC=C1)S MCULE-8297385152 [0,0,1,1,0,0|1,1,0]=4 921 B10R1.61 O=C(O)C1=C(C=CC=N1)O MCULE-7115836080 [0,0,1,1,0,0|2,0,0]=4 922 B10R1.61 O=C(O)C1=C(C=CN=C1)O MCULE-9587370315 [0,0,1,1,0,0|2,0,0]=4 923 B10R1.61 O=C(O)C1=C(C=NC=C1)O MCULE-6913534695 [0,0,1,1,0,0|2,0,0]=4 924 B10R1.61 O=C(O)C1=CC=CC=C1F MCULE-2885931404 [0,0,1,1,0,0|2,0,0]=4 925 B10R1.61 O=C(O)C1=CC=CC=C1I MCULE-5987010449 [0,0,1,1,0,0|2,0,0]=4 926 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8407868694 [0,0,1,1,0,0|1,0,0]=3 927 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8756695354 [0,0,1,1,0,0|1,0,0]=3 928 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-9332636114 [0,0,1,1,0,0|1,0,0]=3 929 B10R1.61 O=C(O)C1=CC=CN=C1O MCULE-3119679537 [0,0,1,1,0,0|2,0,0]=4 930 B10R1.61 O=C([O-])C1=C(C=CC=C1)Cl MCULE-5343724494 [0,0,1,1,0,0|2,0,0]=4 931 B10R1.61 O=C([O-])C1=C(C=CC=C1)O MCULE-8473693653 [0,0,1,1,0,0|1,0,0]=3 932 B10R1.61 O=C([O-])C1=C(C=CC=C1)S MCULE-8341188760 [0,0,1,1,0,0|1,1,0]=4 933 B10R1.61 O=C([O-])C1=C(C=CN=C1)O MCULE-5831902195 [0,0,1,1,0,0|2,0,0]=4 934 B10R1.61 O=C([O-])C1=C(N=CC=C1)O MCULE-9169400221 [0,0,1,1,0,0|2,0,0]=4 935 B10R1.61 O=C([O-])C1=CC=CC=C1Cl MCULE-5178645893 [0,0,1,1,0,0|2,0,0]=4 936 B10R1.61 O=C([O-])C1=CC=CC=C1F MCULE-2391457515 [0,0,1,1,0,0|2,0,0]=4 937 B10R1.61 O=C([O-])C1=CC=CC=C1O MCULE-9355450041 [0,0,1,1,0,0|1,0,0]=3 938 B10R1.61 O=N(=O)C1=C(C=CC=C1)O MCULE-1415513135 [0,0,1,1,0,0|2,0,0]=4 939 B10R1.61 O=P(O)C1=C(C=CC=C1)O MCULE-9956328914 [0,0,1,1,0,0|2,0,0]=4 940 B10R1.61 OC(=S)C1=CC=CC=C1O MCULE-2639793618 [0,0,1,1,0,0|1,0,1]=4 941 B10R1.61 OC1=C(C=CC=C1)C(=S)S MCULE-7166145980 [0,0,1,1,0,0|1,1,0]=4 942 B10R1.31 CC(=O)C1=CNC(=C1)C=O MCULE-6111275994 [0,0,1,1,0,0|2,0,0]=4 943 B10R1.31 O=CC1=CC(=CO1)C(=O)O MCULE-6941989821 [0,0,1,1,0,0|2,0,0]=4 944 B10R1.1 C=CCC1=CC=C(C=C1)C MCULE-7278058379 [0,0,1,1,0,0|2,0,0]=4 945 B10R1.1 C=COC1=CC=C(C=C1)Br MCULE-8053679121 [0,0,1,1,0,0|1,0,1]=4 946 B10R1.1 C=COC1=CC=C(C=C1)Cl MCULE-9952767373 [0,0,1,1,0,0|1,0,1]=4 947 B10R1.1 C=COC1=CC=C(C=C1)I MCULE-7067199595 [0,0,1,1,0,0|1,0,1]=4 948 B10R1.1 C=COC1=CC=C(C=C1)N MCULE-7721091067 [0,0,1,1,0,0|1,0,1]=4 949 B10R1.30 C=CC1=C(C=CC(=C1)C)C MCULE-1256375998 [0,0,1,1,0,0|2,0,0]=4 950 B10R1.30 C=CC1=C(C=CC(=C1)C)Cl MCULE-6875488347 [0,0,1,1,0,0|2,0,0]=4 951 B10R1.30 C=CC1=C(C=CC(=C1)F)O MCULE-5582147556 [0,0,1,1,0,0|1,0,1]=4 952 B10R1.30 C=CC1=NC(=CC=C1O)C MCULE-6524504934 [0,0,1,1,0,0|1,0,0]=3 953 B10R1.30 CC1=CC(=C(C=C1)O)C=O MCULE-3930696324 [0,0,1,1,0,0|2,0,0]=4 954 B10R1.30 CC1=NC(=C(C=C1)O)C=O MCULE-6295280009 [0,0,1,1,0,0|2,0,0]=4 955 B10R1.59 CC(=O)C1=C(OC(=C1)C)C MCULE-2075004152 [0,0,1,1,0,0|0,0,2]=4 956 B10R1.113 C=C(C)C1=CC(=CC=C1)C MCULE-5638990692 [0,0,1,1,0,0|2,0,0]=4 957 B10R1.113 C=C(C)C1=CC(=CC=C1)Cl MCULE-7553675017 [0,0,1,1,0,0|2,0,0]=4 958 B10R1.113 C=C(C)C1=CC(=CC=C1)N MCULE-5362611279 [0,0,1,1,0,0|2,0,0]=4 959 B10R1.113 C=C(C)C1=CC=CC(=C1)Br MCULE-6368963869 [0,0,1,1,0,0|2,0,0]=4 960 B10R1.113 CC(=O)C1=CC(=CC=C1)Br MCULE-5176622974 [0,0,1,1,0,0|1,0,0]=3 961 B10R1.113 CC(=O)C1=CC(=CC=C1)C MCULE-9520106797 [0,0,1,1,0,0|1,0,0]=3 962 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl MCULE-5149161152 [0,0,1,1,0,0|1,0,0]=3 963 B10R1.113 CC(=O)C1=CC(=CC=C1)F MCULE-8561259484 [0,0,1,1,0,0|1,0,0]=3 964 B10R1.113 CC(=O)C1=CC(=CC=C1)N MCULE-6635867482 [0,0,1,1,0,0|1,0,0]=3 965 B10R1.113 CC(=O)C1=CC(=CN=C1)C MCULE-5628044845 [0,0,1,1,0,0|2,0,0]=4 966 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl MCULE-3873806121 [0,0,1,1,0,0|2,0,0]=4 967 B10R1.113 CC(=O)C1=CC(=CN=C1)F MCULE-3863098963 [0,0,1,1,0,0|2,0,0]=4 968 B10R1.113 CC(=O)C1=CC(=CN=C1)F MCULE-9845484449 [0,0,1,1,0,0|2,0,0]=4 969 B10R1.113 CC(=O)C1=CC(=CN=C1)O MCULE-9488751647 [0,0,1,1,0,0|1,0,0]=3 970 B10R1.113 CC(=O)C1=CC(=NC=C1)Br MCULE-6472726710 [0,0,1,1,0,0|2,0,0]=4 971 B10R1.113 CC(=O)C1=CC(=NC=C1)Br MCULE-9200448193 [0,0,1,1,0,0|2,0,0]=4 972 B10R1.113 CC(=O)C1=CC(=NC=C1)C MCULE-5557262548 [0,0,1,1,0,0|1,0,1]=4 973 B10R1.113 CC(=O)C1=CC(=NC=C1)N MCULE-3900813387 [0,0,1,1,0,0|2,0,0]=4 974 B10R1.113 CC(=O)C1=CC(=O)NC=C1 MCULE-4212592174 [0,0,1,1,0,0|1,0,1]=4 975 B10R1.113 CC(=O)C1=CC=CC(=C1)I MCULE-6996442049 [0,0,1,1,0,0|1,0,0]=3 976 B10R1.113 CC(=O)C1=CC=CC(=C1)O MCULE-8431429231 [0,0,1,1,0,0|0,0,0]=2 977 B10R1.113 CC(=O)C1=CC=CC(=O)N1 MCULE-6452912207 [0,0,1,1,0,0|1,0,1]=4 978 B10R1.113 CC(=O)C1=CC=NC(=C1)Cl MCULE-6845382822 [0,0,1,1,0,0|2,0,0]=4 979 B10R1.113 CC(=O)C1=CC=NC(=C1)F MCULE-7124532428 [0,0,1,1,0,0|2,0,0]=4 980 B10R1.113 CC(=O)C1=CN=CC(=C1)Br MCULE-9805827315 [0,0,1,1,0,0|2,0,0]=4 981 B10R1.113 CC(=O)C1=C[N+](=CC=C1)[O-] MCULE-9388710949 [0,0,1,1,0,0|1,0,1]=4 982 B10R1.113 CC(=O)C1=NC(=CC=C1)Br MCULE-3252603541 [0,0,1,1,0,0|2,0,0]=4 983 B10R1.113 CC(=O)C1=NC(=CC=C1)C MCULE-4697560877 [0,0,1,1,0,0|2,0,0]=4 984 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl MCULE-3227549288 [0,0,1,1,0,0|2,0,0]=4 985 B10R1.113 CC(=O)C1=NC(=CC=C1)F MCULE-7462375676 [0,0,1,1,0,0|2,0,0]=4 986 B10R1.113 CC(=O)C1=NC(=CC=C1)N MCULE-7662462799 [0,0,1,1,0,0|2,0,0]=4 987 B10R1.113 CC(=O)C1=NC=CC(=C1)Br MCULE-2260195767 [0,0,1,1,0,0|2,0,0]=4 988 B10R1.113 CC(=O)C1=NC=CC(=C1)C MCULE-4788724458 [0,0,1,1,0,0|2,0,0]=4 989 B10R1.113 CC(=O)C1=NC=CC(=C1)Cl MCULE-3936629396 [0,0,1,1,0,0|2,0,0]=4 990 B10R1.113 CC(=O)C1=NC=CC(=C1)N MCULE-2904070205 [0,0,1,1,0,0|2,0,0]=4 991 B10R1.113 CC(C)C1=CC=CC(=C1)O MCULE-4508758047 [0,0,1,1,0,0|1,0,1]=4 992 B10R1.113 CC(N)C1=CC(=CC=C1)O MCULE-3648727592 [0,0,1,1,0,0|1,0,1]=4 993 B10R1.113 CC(N)C1=CC(=CC=C1)O MCULE-4518341948 [0,0,1,1,0,0|1,0,1]=4 994 B10R1.113 CC(N)C1=CC=CC(=C1)O MCULE-3464696398 [0,0,1,1,0,0|1,0,1]=4 995 B10R1.113 CC(N)C1=CC=CC(=C1)O MCULE-4195516280 [0,0,1,1,0,0|1,0,1]=4 996 B10R1.113 CC(O)C1=CC(=CC=C1)O MCULE-3128044978 [0,0,1,1,0,0|0,0,2]=4 997 B10R1.113 CC1=CC(=CC=C1)C(=O)Cl MCULE-8203384532 [0,0,1,1,0,0|2,0,0]=4 998 B10R1.113 CC1=CC(=CC=C1)C(=O)N MCULE-2788714810 [0,0,1,1,0,0|2,0,0]=4 999 B10R1.113 CC1=CC(=CC=C1)C(=O)O MCULE-8632144278 [0,0,1,1,0,0|2,0,0]=4 1000 B10R1.113 CC1=CC=CC(=C1)S(=O)C MCULE-1455363370 [0,0,1,1,0,0|2,0,0]=4 1001 B10R1.113 CN(C)C1=CC=CC(=C1)O MCULE-9520830956 [0,0,1,1,0,0|2,0,0]=4 1002 B10R1.113 CS(=O)C1=CC(=CC=C1)Br MCULE-1704256706 [0,0,1,1,0,0|2,0,0]=4 1003 B10R1.113 CS(=O)C1=CC(=CC=C1)N MCULE-9312934766 [0,0,1,1,0,0|2,0,0]=4 1004 B10R1.113 CS(=O)C1=CC(=CC=C1)N MCULE-9447170147 [0,0,1,1,0,0|2,0,0]=4 1005 B10R1.113 C[C@@H](N)C1=CC(=CC=C1)O MCULE-3651282622 [0,0,1,1,0,0|1,0,1]=4 1006 B10R1.113 C[C@@H](N)C1=CC(=CC=C1)O MCULE-5786102127 [0,0,1,1,0,0|1,0,1]=4 1007 B10R1.113 C[C@@H](N)C1=CC(=CC=C1)O MCULE-8450245524 [0,0,1,1,0,0|1,0,1]=4 1008 B10R1.113 C[C@@H](N)C1=CC(=CC=C1)O MCULE-9815414319 [0,0,1,1,0,0|1,0,1]=4 1009 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O MCULE-1794661167 [0,0,1,1,0,0|0,0,2]=4 1010 B10R1.113 C[C@H](N)C1=CC(=CC=C1)O MCULE-4140597813 [0,0,1,1,0,0|1,0,1]=4 1011 B10R1.113 C[C@H](N)C1=CC(=CC=C1)O MCULE-6147632634 [0,0,1,1,0,0|1,0,1]=4 1012 B10R1.113 C[C@H](N)C1=CC(=CC=C1)O MCULE-9625524293 [0,0,1,1,0,0|1,0,1]=4 1013 B10R1.113 C[C@H](N)C1=CC=CC(=C1)O MCULE-4688329441 [0,0,1,1,0,0|1,0,1]=4 1014 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O MCULE-9551333858 [0,0,1,1,0,0|0,0,2]=4 1015 B10R1.113 N=C(N)C1=CC=CC(=C1)O MCULE-5386143389 [0,0,1,1,0,0|2,0,0]=4 1016 B10R1.113 N=C(N)C1=CC=CC(=C1)O MCULE-8437940685 [0,0,1,1,0,0|2,0,0]=4 1017 B10R1.113 NC(=O)C1=CC(=CC=C1)Br MCULE-1762915886 [0,0,1,1,0,0|2,0,0]=4 1018 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl MCULE-3913711395 [0,0,1,1,0,0|2,0,0]=4 1019 B10R1.113 NC(=O)C1=CC(=CC=C1)F MCULE-6430101504 [0,0,1,1,0,0|2,0,0]=4 1020 B10R1.113 NC(=O)C1=CC(=CC=C1)I MCULE-6790755279 [0,0,1,1,0,0|2,0,0]=4 1021 B10R1.113 NC(=O)C1=CC(=CC=C1)N MCULE-2277005047 [0,0,1,1,0,0|2,0,0]=4 1022 B10R1.113 NC(=O)C1=CC(=CC=C1)O MCULE-9599926365 [0,0,1,1,0,0|1,0,0]=3 1023 B10R1.113 NC(=O)C1=CC(=CC=C1)S MCULE-7706529187 [0,0,1,1,0,0|1,1,0]=4 1024 B10R1.113 NC(=O)C1=NC(=CC=C1)O MCULE-8529656036 [0,0,1,1,0,0|2,0,0]=4 1025 B10R1.113 NC(=S)C1=CC(=CC=C1)O MCULE-2807829866 [0,0,1,1,0,0|1,1,0]=4 1026 B10R1.113 NC1=CC(=CC=C1)C(=O)[O-] MCULE-3791765327 [0,0,1,1,0,0|2,0,0]=4 1027 B10R1.113 NC1=CC=CC(=C1)C(=O)O MCULE-8263489676 [0,0,1,1,0,0|2,0,0]=4 1028 B10R1.113 O=C(Cl)C1=CC(=CC=C1)F MCULE-4519623851 [0,0,1,1,0,0|2,0,0]=4 1029 B10R1.113 O=C(Cl)C1=CC(=CC=C1)O MCULE-9380224639 [0,0,1,1,0,0|1,0,0]=3 1030 B10R1.113 O=C(Cl)C1=CC(=CC=C1)S MCULE-2583133141 [0,0,1,1,0,0|1,1,0]=4 1031 B10R1.113 O=C(Cl)C1=CC=CC(=C1)Br MCULE-6552885714 [0,0,1,1,0,0|2,0,0]=4 1032 B10R1.113 O=C(Cl)C1=CC=CC(=C1)Cl MCULE-7486326938 [0,0,1,1,0,0|2,0,0]=4 1033 B10R1.113 O=C(Cl)C1=CC=CC(=C1)I MCULE-2962064987 [0,0,1,1,0,0|2,0,0]=4 1034 B10R1.113 O=C(Cl)C1=NC=CC(=C1)O MCULE-8586507670 [0,0,1,1,0,0|2,0,0]=4 1035 B10R1.113 O=C(O)C1=CC(=CC=C1)Br MCULE-8805391978 [0,0,1,1,0,0|2,0,0]=4 1036 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl MCULE-4475337074 [0,0,1,1,0,0|2,0,0]=4 1037 B10R1.113 O=C(O)C1=CC(=CC=C1)F MCULE-6577870473 [0,0,1,1,0,0|2,0,0]=4 1038 B10R1.113 O=C(O)C1=CC(=CC=C1)I MCULE-7599924260 [0,0,1,1,0,0|2,0,0]=4 1039 B10R1.113 O=C(O)C1=CC(=CC=C1)O MCULE-3607182166 [0,0,1,1,0,0|1,0,0]=3 1040 B10R1.113 O=C(O)C1=CC(=CC=C1)S MCULE-3153980516 [0,0,1,1,0,0|1,1,0]=4 1041 B10R1.113 O=C(O)C1=CN=CC(=C1)O MCULE-4896018532 [0,0,1,1,0,0|2,0,0]=4 1042 B10R1.113 O=C(O)C1=NC(=CC=C1)O MCULE-9188843949 [0,0,1,1,0,0|2,0,0]=4 1043 B10R1.113 O=C(O)C1=NC=CC(=C1)O MCULE-2705303745 [0,0,1,1,0,0|2,0,0]=4 1044 B10R1.113 O=C(O)C1=NC=CC(=C1)O MCULE-7268708037 [0,0,1,1,0,0|2,0,0]=4 1045 B10R1.113 O=C([O-])C1=CC(=CC=C1)Cl MCULE-7876403307 [0,0,1,1,0,0|2,0,0]=4 1046 B10R1.113 O=C([O-])C1=CC=CC(=C1)F MCULE-2451936872 [0,0,1,1,0,0|2,0,0]=4 1047 B10R1.113 O=C([O-])C1=CC=CC(=C1)I MCULE-8376030361 [0,0,1,1,0,0|2,0,0]=4 1048 B10R1.113 O=C([O-])C1=CC=CC(=C1)O MCULE-8042546089 [0,0,1,1,0,0|1,0,0]=3 1049 B10R1.113 O=N(=O)C1=CC=CC(=C1)O MCULE-3385567100 [0,0,1,1,0,0|2,0,0]=4 1050 B10R1.113 [NH3+]C1=CC=CC(=C1)C(=O)O MCULE-9535213423 [0,0,1,1,0,0|2,0,0]=4 1051 B10R2.7 C1=CC2=C(C=C1)NC=C2 MCULE-9442796928 [1,0,0,1,0,0|1,0,1]=4 1052 B10R2.7 C1=CC2=C(C=C1)OC=C2 MCULE-3934334695 [1,0,0,1,0,0|0,0,1]=3 1053 B10R2.7 C1=CC2=C(C=C1)ON=C2 MCULE-9569919242 [1,0,0,1,0,0|1,0,1]=4 1054 B10R2.7 C1=CC2=C(C=C1)SC=C2 MCULE-7277751906 [1,0,0,1,0,0|0,1,1]=4 1055 B10R2.7 C1=CC2=C(C=C1)[Se]C=C2 MCULE-9884899713 [1,0,0,1,0,0|0,1,1]=4 1056 B10R2.7 C1=CC2=C(C=CO2)C=N1 MCULE-5731221613 [1,0,0,1,0,0|1,0,1]=4 1057 B10R2.7 C1=CC2=C(C=CO2)N=C1 MCULE-9945223360 [1,0,0,1,0,0|1,0,0]=3 1058 B10R2.7 C1=CC2=C(C=C[Se]2)N=C1 MCULE-7328575543 [1,0,0,1,0,0|1,1,0]=4 1059 B10R2.7 C1=CC2=C(C=N1)OC=C2 MCULE-7906357381 [1,0,0,1,0,0|1,0,1]=4 1060 B10R2.7 C1=CC2=C(N=C1)OC=C2 MCULE-5169272501 [1,0,0,1,0,0|1,0,1]=4 1061 B10R2.7 C1=CC2=CC=CN2C=C1 MCULE-8481145574 [1,0,0,1,0,0|1,0,1]=4 1062 B10R2.7 C1=CC=C2CC=CC2=C1 MCULE-7457676330 [1,0,0,1,0,0|1,0,1]=4 1063 B10R2.7 C1=CC=C2OC=NC2=C1 MCULE-1964652284 [1,0,0,1,0,0|1,0,1]=4 1064 B10R2.7 C1=CCC2=C(C1)C=CN2 MCULE-4118048419 [1,0,0,1,0,0|1,0,1]=4 1065 B10R2.7 C1=CN=C2C=CNC2=C1 MCULE-5738930040 [1,0,0,1,0,0|2,0,0]=4 1066 B10R2.7 C1=CN=C2C=CSC2=C1 MCULE-2589020554 [1,0,0,1,0,0|1,1,0]=4 1067 B10R2.7 C1=CN=C2N=COC2=C1 MCULE-1325564586 [1,0,0,1,0,0|2,0,0]=4 1068 B10R2.7 C1=CNC2=CC=NC2=C1 MCULE-4085393684 [1,0,0,1,0,0|2,0,0]=4 1069 B10R2.2 CC1=CC2=C(S1)C=CS2 MCULE-8870669212 [0,0,0,1,1,0|0,2,0]=4 1070 B10R2.2 O=C1CC2=C(C1)NC=C2 MCULE-6737209084 [0,0,0,1,1,0|1,0,1]=4 1071 B10R2.2 O=C1CC2=CC=CN2C1 MCULE-2170204532 [0,0,0,1,1,0|1,0,1]=4 1072 B10R2.31 NC1=CC=C2C=CC2=C1 MCULE-7134965111 [0,0,0,1,1,0|1,0,1]=4 1073 B12R2.24 BrC1=CC2=C(C=C1)OCC=C2 MCULE-4761234371 [0,0,0,1,0,1|1,0,1]=4 1074 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 MCULE-4788053663 [0,0,0,1,0,1|2,0,0]=4 1075 B12R2.24 CC1=CC2=C(C=C1)N=CC=N2 MCULE-6198023341 [0,0,0,1,0,1|2,0,0]=4 1076 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 MCULE-4388510802 [0,0,0,1,0,1|2,0,0]=4 1077 B12R2.24 CC1=CC2=C(C=CC=N2)C=C1 MCULE-9653031371 [0,0,0,1,0,1|2,0,0]=4 1078 B12R2.24 CC1=CC2=C(C=CN=C2)C=C1 MCULE-8913295463 [0,0,0,1,0,1|2,0,0]=4 1079 B12R2.24 CC1=CC2=CN=CN=C2C=C1 MCULE-3230435140 [0,0,0,1,0,1|2,0,0]=4 1080 B12R2.24 CC1=CC=C2C=NC=CC2=C1 MCULE-4125004565 [0,0,0,1,0,1|2,0,0]=4 1081 B12R2.24 CC1=CC=C2N=CC=CC2=C1 MCULE-3783784137 [0,0,0,1,0,1|2,0,0]=4 1082 B12R2.24 CC1=CC=C2N=CC=CC2=N1 MCULE-6321089455 [0,0,0,1,0,1|2,0,0]=4 1083 B12R2.24 CC1=CC=C2N=CC=NC2=N1 MCULE-8471607804 [0,0,0,1,0,1|2,0,0]=4 1084 B12R2.24 CC1=NC2=CC=CC=C2C=C1 MCULE-7892906832 [0,0,0,1,0,1|2,0,0]=4 1085 B12R2.24 CC1=NC2=CN=CC=C2C=C1 MCULE-6547737735 [0,0,0,1,0,1|2,0,0]=4 1086 B12R2.24 CC1=NC2=NC=CC=C2C=C1 MCULE-4222229618 [0,0,0,1,0,1|2,0,0]=4 1087 B12R2.24 O=C1C=CC2=C(S1)C=CC=C2 MCULE-9171342186 [0,0,0,1,0,1|2,0,0]=4 1088 B12R2.24 O=C1C=CC2=CC=CC=C2N1 MCULE-5331233860 [0,0,0,1,0,1|2,0,0]=4 1089 B12R2.24 O=C1C=CC2=CC=CC=C2O1 MCULE-5433669098 [0,0,0,1,0,1|2,0,0]=4 1090 B12R2.24 O=C1C=CC2=CC=CC=C2[N-]1 MCULE-7217411125 [0,0,0,1,0,1|2,0,0]=4 1091 B12R2.24 O=C1C=CC2=CC=NC=C2N1 MCULE-9826430049 [0,0,0,1,0,1|2,0,0]=4 1092 B12R2.24 O=C1C=CC2=CN=CC=C2N1 MCULE-6769261294 [0,0,0,1,0,1|2,0,0]=4 1093 B12R2.24 O=C1C=CC2=CNC=CC2=N1 MCULE-1218657874 [0,0,0,1,0,1|2,0,0]=4 1094 B12R2.24 O=C1C=CC2=NC=CN=C2N1 MCULE-3938088930 [0,0,0,1,0,1|2,0,0]=4 1095 B12R2.24 OC1=CC=C2OCC=CC2=C1 MCULE-8966912874 [0,0,0,1,0,1|0,0,2]=4 1096 B12R2.3190 O=C(O)C1=CC2=CC=CC=C12 MCULE-4865410555 [0,0,0,1,0,1|2,0,0]=4 1097 B12R2.6 CC1=CSC(=N1)C2=CC=CS2 MCULE-3998835848 [0,0,0,1,0,1|1,1,0]=4 1098 B12R2.6 CC1=NC(=CS1)C2=CC=CS2 MCULE-8209510051 [0,0,0,1,0,1|1,1,0]=4 1099 B12R2.6 CC1=NNC(=C1)C2=CC=CO2 MCULE-1677776889 [0,0,0,1,0,1|2,0,0]=4 1100 B12R2.6 CN1C=C(C=N1)C2=CC=CO2 MCULE-6216480722 [0,0,0,1,0,1|2,0,0]=4 1101 B12R2.6 NC1=NC(=CS1)C2=CC=CO2 MCULE-8891453367 [0,0,0,1,0,1|2,0,0]=4 1102 B12R2.6 O=C1CC(=NN1)C2=CC=CO2 MCULE-2852463328 [0,0,0,1,0,1|1,0,0]=3 1103 B12R2.6 O=C1CC(=NN1)C2=CC=CS2 MCULE-2459476327 [0,0,0,1,0,1|1,1,0]=4 1104 B12R2.6 O=C1CC(=NO1)C2=CC=CO2 MCULE-6975597952 [0,0,0,1,0,1|1,0,0]=3 1105 B12R2.6 O=C1CC(CN1)C2=CC=CO2 MCULE-9948286775 [0,0,0,1,0,1|0,0,2]=4 1106 B12R2.6 O=C1NC=C(N1)C2=CC=CS2 MCULE-2012074676 [0,0,0,1,0,1|1,1,0]=4 1107 B12R2.6 O=C1NN=C(O1)C2=CC=CO2 MCULE-6773781340 [0,0,0,1,0,1|2,0,0]=4 1108 B12R2.1354 CC(=O)C1CC1C2=CC=CO2 MCULE-2239066013 [0,0,0,1,0,1|0,0,2]=4 1109 B12R2.1362 CC(=O)C1=CN=C2N1C=CS2 MCULE-5669099463 [0,0,0,1,0,1|1,1,0]=4 1110 B12R2.44 BrCC1=CC=C2OC=CC2=C1 MCULE-5605429307 [0,1,0,1,0,0|1,0,0]=3 1111 B12R2.44 BrCC1=CC=C2OC=NC2=C1 MCULE-7730206017 [0,1,0,1,0,0|2,0,0]=4 1112 B12R2.44 BrCC1=CC=C2SC=CC2=C1 MCULE-2816364043 [0,1,0,1,0,0|1,1,0]=4 1113 B12R2.44 CCC1=CC2=C(C=C1)NC=C2 MCULE-3152099050 [0,1,0,1,0,0|2,0,0]=4 1114 B12R2.44 COC1=CC2=C(C=C1)NC=C2 MCULE-5809392169 [0,1,0,1,0,0|2,0,0]=4 1115 B12R2.44 COC1=CC2=C(C=C1)OC=C2 MCULE-5975007992 [0,1,0,1,0,0|1,0,0]=3 1116 B12R2.44 COC1=CC2=C(C=C1)OC=N2 MCULE-1530618691 [0,1,0,1,0,0|2,0,0]=4 1117 B12R2.44 COC1=CC2=C(C=C1)ON=C2 MCULE-5597008827 [0,1,0,1,0,0|2,0,0]=4 1118 B12R2.44 COC1=CC=C2CC=CC2=C1 MCULE-8462326727 [0,1,0,1,0,0|2,0,0]=4 1119 B12R2.44 COC1=CC=C2SC=CC2=C1 MCULE-5220172706 [0,1,0,1,0,0|1,1,0]=4 1120 B12R2.44 COC1=NC2=C(C=C1)NC=C2 MCULE-9207204633 [0,1,0,1,0,0|2,0,0]=4 1121 B12R2.44 CSC1=CC2=C(C=C1)NC=C2 MCULE-8083023879 [0,1,0,1,0,0|2,0,0]=4 1122 B12R2.44 N#CC1=CC2=C(C=C1)OC=C2 MCULE-6088043633 [0,1,0,1,0,0|1,0,1]=4 1123 B12R2.44 NCC1=CC2=C(C=C1)NC=C2 MCULE-3019621490 [0,1,0,1,0,0|2,0,0]=4 1124 B12R2.44 NCC1=CC2=C(C=C1)NC=C2 MCULE-3321446339 [0,1,0,1,0,0|2,0,0]=4 1125 B12R2.44 NCC1=CC2=C(C=C1)OC=C2 MCULE-1635340371 [0,1,0,1,0,0|1,0,0]=3 1126 B12R2.44 NCC1=CC2=C(C=C1)OC=C2 MCULE-9639861633 [0,1,0,1,0,0|1,0,0]=3 1127 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 MCULE-6329693416 [0,1,0,1,0,0|1,1,0]=4 1128 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 MCULE-9979532686 [0,1,0,1,0,0|1,1,0]=4 1129 B12R2.44 NCC1=CC=C2NC=CC2=N1 MCULE-2437346861 [0,1,0,1,0,0|2,0,0]=4 1130 B12R2.44 NCC1=CC=C2OC=NC2=C1 MCULE-4026978347 [0,1,0,1,0,0|2,0,0]=4 1131 B12R2.44 NCC1=CC=C2OC=NC2=C1 MCULE-8509782813 [0,1,0,1,0,0|2,0,0]=4 1132 B12R2.44 NCC1=NC2=C(C=C1)NC=C2 MCULE-3408609708 [0,1,0,1,0,0|2,0,0]=4 1133 B12R2.44 O=CC1=CC2=C(C=C1)OC=N2 MCULE-5208292674 [0,1,0,1,0,0|1,0,1]=4 1134 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 MCULE-7412686385 [0,1,0,1,0,0|0,1,1]=4 1135 B12R2.44 O=CC1=CC2=C(C=N1)OC=C2 MCULE-3765897262 [0,1,0,1,0,0|1,0,1]=4 1136 B12R2.44 O=CC1=CC=C2NC=CC2=C1 MCULE-9257177939 [0,1,0,1,0,0|1,0,1]=4 1137 B12R2.44 O=CC1=CC=C2NC=CC2=N1 MCULE-1364076358 [0,1,0,1,0,0|2,0,0]=4 1138 B12R2.44 O=CC1=CC=C2OC=CC2=C1 MCULE-8661033963 [0,1,0,1,0,0|0,0,1]=3 1139 B12R2.44 O=CC1=CN=C2OC=CC2=C1 MCULE-1941526621 [0,1,0,1,0,0|1,0,1]=4 1140 B12R2.44 O=CC1=NC2=C(C=C1)OC=C2 MCULE-3133203892 [0,1,0,1,0,0|1,0,0]=3 1141 B12R2.44 OCC1=CC2=C(C=C1)NC=C2 MCULE-3615759957 [0,1,0,1,0,0|2,0,0]=4 1142 B12R2.44 OCC1=CC2=C(C=C1)SC=C2 MCULE-7021008008 [0,1,0,1,0,0|1,1,0]=4 1143 B12R2.44 OCC1=CC2=C(C=N1)OC=C2 MCULE-1417999286 [0,1,0,1,0,0|2,0,0]=4 1144 B12R2.44 OCC1=CC=C2NC=CC2=N1 MCULE-3973467911 [0,1,0,1,0,0|2,0,0]=4 1145 B12R2.44 OCC1=CC=C2OC=CC2=C1 MCULE-5679428281 [0,1,0,1,0,0|1,0,0]=3 1146 B12R2.44 OCC1=CC=C2SC=CC2=N1 MCULE-8460244769 [0,1,0,1,0,0|1,1,0]=4 1147 B12R2.44 OCC1=CN=C2OC=CC2=C1 MCULE-9938977209 [0,1,0,1,0,0|2,0,0]=4 1148 B12R2.82 CC1=C(C2=C(C=C1)NC=C2)Br MCULE-1474896126 [0,1,0,1,0,0|2,0,0]=4 1149 B12R2.82 CC1=C(C2=C(C=C1)NC=C2)C MCULE-4386696603 [0,1,0,1,0,0|2,0,0]=4 1150 B12R2.82 CC1=C(C2=C(C=C1)NC=C2)Cl MCULE-3657042910 [0,1,0,1,0,0|2,0,0]=4 1151 B12R2.82 CC1=C(C=CC2=C1C=CN2)Br MCULE-3353121981 [0,1,0,1,0,0|2,0,0]=4 1152 B12R2.82 CC1=C(C=CC2=C1C=CN2)F MCULE-4482265772 [0,1,0,1,0,0|2,0,0]=4 1153 B12R2.82 CC1=C(C=CC2=C1C=CN2)N MCULE-3490531281 [0,1,0,1,0,0|2,0,0]=4 1154 B12R2.82 CC1=C(C=CC2=C1C=CN2)O MCULE-5997669601 [0,1,0,1,0,0|1,0,1]=4 1155 B12R2.82 CC1=CC=C2NC=CC2=C1I MCULE-9243428904 [0,1,0,1,0,0|2,0,0]=4 1156 B12R2.82 CC1=CC=C2NC=CC2=C1O MCULE-6571225490 [0,1,0,1,0,0|1,0,1]=4 1157 B12R2.82 CN1C=CC2=C(C1=O)C=CO2 MCULE-4927212965 [0,1,0,1,0,0|1,0,0]=3 1158 B12R2.82 ClC1=C2C=COC2=CC=C1Br MCULE-9736039947 [0,1,0,1,0,0|1,0,1]=4 1159 B12R2.82 ClC1=CC=C2OC=CC2=C1Br MCULE-4384814676 [0,1,0,1,0,0|1,0,1]=4 1160 B12R2.82 FC1=C2C=COC2=CC=C1Br MCULE-2785159161 [0,1,0,1,0,0|1,0,1]=4 1161 B12R2.82 FC1=CC=C2OC=CC2=C1Br MCULE-1746855367 [0,1,0,1,0,0|1,0,1]=4 1162 B12R2.82 NC1=C(C2=C(C=C1)OC=C2)F MCULE-3942482830 [0,1,0,1,0,0|1,0,1]=4 1163 B12R2.82 NC1=C(C2=C(C=C1)OC=C2)F MCULE-4880739728 [0,1,0,1,0,0|1,0,1]=4 1164 B12R2.83 CC1=CC=C2C=CC=C2C=C1 MCULE-5753433452 [0,1,0,1,0,0|2,0,0]=4 1165 B12R2.100 CC1=C(C=C2NC=CC2=C1)C MCULE-4075462422 [0,1,0,1,0,0|2,0,0]=4 1166 B12R2.100 CC1=C(C=C2NC=CC2=C1)F MCULE-4032628070 [0,1,0,1,0,0|2,0,0]=4 1167 B12R2.100 CC1=C(C=C2NC=CC2=C1)O MCULE-2330488633 [0,1,0,1,0,0|2,0,0]=4 1168 B12R2.100 CC1=C(C=C2NC=CC2=N1)Br MCULE-1863495104 [0,1,0,1,0,0|2,0,0]=4 1169 B12R2.100 CC1=C(C=C2OC=NC2=C1)Br MCULE-9721922423 [0,1,0,1,0,0|2,0,0]=4 1170 B12R2.100 CC1=C(C=C2SC=CC2=C1)Br MCULE-1373299124 [0,1,0,1,0,0|1,1,0]=4 1171 B12R2.100 CC1=CC2=C(C=C1Br)NC=C2 MCULE-4944516047 [0,1,0,1,0,0|2,0,0]=4 1172 B12R2.100 CC1=CC2=C(C=C1Cl)NC=C2 MCULE-1610486205 [0,1,0,1,0,0|2,0,0]=4 1173 B12R2.100 CC1=CC2=C(C=C1I)NC=C2 MCULE-3763720740 [0,1,0,1,0,0|2,0,0]=4 1174 B12R2.100 CC1=CC2=C(C=C1N)NC=C2 MCULE-8045209152 [0,1,0,1,0,0|2,0,0]=4 1175 B12R2.100 CC1=CC2=C(C=CO2)C=C1Br MCULE-5329471031 [0,1,0,1,0,0|1,0,1]=4 1176 B12R2.100 ClC1=C(C=C2OC=CC2=C1)Br MCULE-4169842901 [0,1,0,1,0,0|1,0,1]=4 1177 B12R2.100 FC1=C(C=C2C=COC2=C1)Br MCULE-7243794836 [0,1,0,1,0,0|1,0,1]=4 1178 B12R2.100 FC1=C(C=C2OC=CC2=C1)Br MCULE-4735964683 [0,1,0,1,0,0|1,0,1]=4 1179 B12R2.252 CC(=O)C1=CC2=C(N1)C=CS2 MCULE-7178568906 [0,1,0,1,0,0|0,1,0]=3 1180 B12R2.252 CC(=O)C1=CC2=C(S1)C=CS2 MCULE-1597322896 [0,1,0,1,0,0|0,1,0]=3 1181 B12R2.252 NC(=O)C1=CC2=C(N1)C=CS2 MCULE-7206766276 [0,1,0,1,0,0|1,1,0]=4 1182 B12R2.252 NC(=O)C1=CC2=C(S1)C=CS2 MCULE-4360205396 [0,1,0,1,0,0|1,1,0]=4 1183 B12R2.252 O=C(Cl)C1=CN2OC=CC2=N1 MCULE-4804238853 [0,1,0,1,0,0|2,0,0]=4 1184 B12R2.252 O=C(O)C1=CC2=C(N1)C=CO2 MCULE-4890412119 [0,1,0,1,0,0|1,0,0]=3 1185 B12R2.252 O=C(O)C1=CC2=C(N1)C=CS2 MCULE-2564302171 [0,1,0,1,0,0|1,1,0]=4 1186 B12R2.252 O=C(O)C1=CC2=C(O1)C=CN2 MCULE-8303697888 [0,1,0,1,0,0|2,0,0]=4 1187 B12R2.252 O=C(O)C1=CC2=C(S1)C=CN2 MCULE-4645433743 [0,1,0,1,0,0|2,0,0]=4 1188 B12R2.252 O=C(O)C1=CC2=C(S1)C=CO2 MCULE-5896832706 [0,1,0,1,0,0|1,0,0]=3 1189 B12R2.252 O=C(O)C1=CC2=C(S1)C=CS2 MCULE-9074494739 [0,1,0,1,0,0|1,1,0]=4 1190 B12R2.252 O=C(O)C1=CC2=C(S1)OC=C2 MCULE-4704847988 [0,1,0,1,0,0|2,0,0]=4 1191 B12R2.252 O=C(O)C1=CC2=C([Se]1)C=CS2 MCULE-1870487907 [0,1,0,1,0,0|1,1,0]=4 1192 B12R2.252 O=C(O)C1=CN2OC=CC2=N1 MCULE-8188807974 [0,1,0,1,0,0|2,0,0]=4 1193 B12R2.132 BrC1=CC=C2OC=C(C2=C1)Br MCULE-6631052910 [0,1,0,1,0,0|1,0,1]=4 1194 B12R2.132 CC1=CC2=C(C=C1)NC=C2Br MCULE-2127146315 [0,1,0,1,0,0|2,0,0]=4 1195 B12R2.132 CC1=CC2=C(C=C1)ON=C2C MCULE-8658314681 [0,1,0,1,0,0|2,0,0]=4 1196 B12R2.132 CC1=CC2=C(C=C1)ON=C2Cl MCULE-1410488265 [0,1,0,1,0,0|2,0,0]=4 1197 B12R2.132 CC1=CC2=C(C=C1)ON=C2N MCULE-3004482376 [0,1,0,1,0,0|2,0,0]=4 1198 B12R2.132 CC1=CC2=C(C=C1)ONC2=O MCULE-6113460133 [0,1,0,1,0,0|2,0,0]=4 1199 B12R2.132 CC1=CC2=C(C=C1)SC=C2C MCULE-3819635764 [0,1,0,1,0,0|1,1,0]=4 1200 B12R2.132 CC1=CC=C2NC=C(C2=N1)Br MCULE-2016751080 [0,1,0,1,0,0|2,0,0]=4 1201 B12R2.132 CC1=CC=C2NC=C(C2=N1)Cl MCULE-1385721869 [0,1,0,1,0,0|2,0,0]=4 1202 B12R2.132 CC1=CC=C2NC=C(C2=N1)F MCULE-7529527824 [0,1,0,1,0,0|2,0,0]=4 1203 B12R2.132 CC1=CC=C2NC=C(C2=N1)I MCULE-8068020923 [0,1,0,1,0,0|2,0,0]=4 1204 B12R2.132 CC1=CC=C2NC=C(C2=N1)N MCULE-6627760602 [0,1,0,1,0,0|2,0,0]=4 1205 B12R2.132 CC1=CC=C2OC=C(C2=C1)C MCULE-1107146475 [0,1,0,1,0,0|1,0,0]=3 1206 B12R2.132 CC1=CC=C2OCC(=O)C2=C1 MCULE-5367143988 [0,1,0,1,0,0|1,0,1]=4 1207 B12R2.132 CC1=COC2=C1C=C(C=C2)Br MCULE-9023749973 [0,1,0,1,0,0|1,0,1]=4 1208 B12R2.132 CC1=COC2=C1C=C(C=C2)Cl MCULE-5378025658 [0,1,0,1,0,0|1,0,1]=4 1209 B12R2.132 CC1=COC2=C1C=C(C=C2)F MCULE-7655977112 [0,1,0,1,0,0|1,0,1]=4 1210 B12R2.132 CC1=COC2=C1C=C(C=C2)N MCULE-5717894128 [0,1,0,1,0,0|1,0,1]=4 1211 B12R2.132 CC1=COC2=C1C=C(C=C2)O MCULE-1168220323 [0,1,0,1,0,0|0,0,2]=4 1212 B12R2.132 ClC1=CC=C2OC=C(C2=N1)Br MCULE-2197002818 [0,1,0,1,0,0|2,0,0]=4 1213 B12R2.132 NC1=CC2=C(C=C1)OC=C2F MCULE-1548038998 [0,1,0,1,0,0|1,0,1]=4 1214 B12R2.132 NC1=CC2=C(C=C1)OC=C2F MCULE-7071484703 [0,1,0,1,0,0|1,0,1]=4 1215 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)N MCULE-8127717383 [0,1,0,1,0,0|2,0,0]=4 1216 B12R2.606 CC1=CC2=C(C=C1)OC(=S)N2 MCULE-6015035665 [0,1,0,1,0,0|2,0,0]=4 1217 B12R2.606 CC1=CC2=C(C=C1)SC(=C2)Br MCULE-1374902156 [0,1,0,1,0,0|1,1,0]=4 1218 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br MCULE-2875841739 [0,1,0,1,0,0|1,0,1]=4 1219 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N MCULE-3312997092 [0,1,0,1,0,0|1,0,1]=4 1220 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)O MCULE-1973204352 [0,1,0,1,0,0|0,0,2]=4 1221 B12R2.606 CC1=CC2=CC(=CC=C2O1)I MCULE-1926138501 [0,1,0,1,0,0|1,0,1]=4 1222 B12R2.606 CC1=CC2=CC(=CC=C2O1)N MCULE-2069238380 [0,1,0,1,0,0|1,0,1]=4 1223 B12R2.606 CC1=CC=C2N=C(C=C2N1)C MCULE-3920581703 [0,1,0,1,0,0|2,0,0]=4 1224 B12R2.606 CC1=CC=C2NC(=CC2=C1)C MCULE-9640369956 [0,1,0,1,0,0|2,0,0]=4 1225 B12R2.606 CC1=CC=C2NC(=CC2=N1)C MCULE-6635949406 [0,1,0,1,0,0|2,0,0]=4 1226 B12R2.606 CC1=CC=C2NC(=CC2=N1)I MCULE-7705119218 [0,1,0,1,0,0|2,0,0]=4 1227 B12R2.606 CC1=CC=C2OC(=NC2=C1)C MCULE-9938291967 [0,1,0,1,0,0|2,0,0]=4 1228 B12R2.606 CC1=CC=C2OC(=NC2=C1)Cl MCULE-1056883160 [0,1,0,1,0,0|2,0,0]=4 1229 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 MCULE-6074705530 [0,1,0,1,0,0|2,0,0]=4 1230 B12R2.606 CC1=CC=C2OC(=O)NC2=N1 MCULE-4394711738 [0,1,0,1,0,0|2,0,0]=4 1231 B12R2.606 CC1=NC2=C(C=C1)OC(=N2)S MCULE-1992322602 [0,1,0,1,0,0|2,0,0]=4 1232 B12R2.606 FC1=CC=C2OC(=CC2=C1)Br MCULE-8492296098 [0,1,0,1,0,0|1,0,1]=4 1233 B12R2.246 BrC1=CC(=C2OC=CC2=C1)Br MCULE-8714069266 [0,1,0,1,0,0|1,0,1]=4 1234 B12R2.246 BrC1=CC2=C(OC=C2)C(=C1)I MCULE-4609584836 [0,1,0,1,0,0|1,0,1]=4 1235 B12R2.246 CC1=C2OC=CC2=CC(=C1)Br MCULE-6941325293 [0,1,0,1,0,0|1,0,1]=4 1236 B12R2.246 CC1=CC(=C2NC=CC2=C1)C MCULE-2388477873 [0,1,0,1,0,0|2,0,0]=4 1237 B12R2.246 CC1=CC(=C2NC=CC2=N1)Cl MCULE-6328520721 [0,1,0,1,0,0|2,0,0]=4 1238 B12R2.246 CC1=CC(=C2NC=CC2=N1)N MCULE-8676337772 [0,1,0,1,0,0|2,0,0]=4 1239 B12R2.246 CC1=CC(=C2OC=CC2=C1)Br MCULE-3116663371 [0,1,0,1,0,0|1,0,0]=3 1240 B12R2.246 CC1=CC(=C2ON=CC2=C1)Br MCULE-9039441625 [0,1,0,1,0,0|2,0,0]=4 1241 B12R2.246 CC1=CC(=C2SC=CC2=C1)Br MCULE-7297831436 [0,1,0,1,0,0|1,1,0]=4 1242 B12R2.246 CC1=CC(=O)C2=C(N1)C=CS2 MCULE-7915172440 [0,1,0,1,0,0|1,1,0]=4 1243 B12R2.246 CC1=CC2=C(NC=C2)C(=C1)Br MCULE-5021537956 [0,1,0,1,0,0|2,0,0]=4 1244 B12R2.246 CC1=CC2=C(NC=C2)C(=C1)F MCULE-5090198480 [0,1,0,1,0,0|2,0,0]=4 1245 B12R2.246 CC1=CC2=C(NC=C2)C(=C1)N MCULE-1194185054 [0,1,0,1,0,0|2,0,0]=4 1246 B12R2.246 CC1=CC2=C(OC=C2)C(=N1)Cl MCULE-5068482443 [0,1,0,1,0,0|2,0,0]=4 1247 B12R2.246 CC1=NC(=C2OC=CC2=N1)Cl MCULE-8165260059 [0,1,0,1,0,0|2,0,0]=4 1248 B12R2.246 ClC1=C2OC=CC2=CC(=C1)Br MCULE-7851785162 [0,1,0,1,0,0|1,0,1]=4 1249 B12R2.246 ClC1=CC(=C2OC=CC2=C1)Br MCULE-6098479725 [0,1,0,1,0,0|1,0,1]=4 1250 B12R2.246 ClC1=CC(=C2OC=CC2=C1)Cl MCULE-3419072600 [0,1,0,1,0,0|1,0,1]=4 1251 B12R2.246 FC1=C2OC=CC2=CC(=C1)Br MCULE-5488691352 [0,1,0,1,0,0|1,0,1]=4 1252 B12R2.246 FC1=CC(=C2OC=CC2=C1)Br MCULE-3538307787 [0,1,0,1,0,0|1,0,1]=4 1253 B12R2.246 OC1=CC(=C2OC=CC2=C1)Br MCULE-5115079342 [0,1,0,1,0,0|0,0,2]=4 1254 B12R2.612 CC1=CC=C2C(=C1)C=CN2C MCULE-6293491336 [0,1,0,1,0,0|2,0,0]=4 1255 B8R1.7 C=C(C)C1=CC=CO1 MCULE-6798465856 [0,0,0,0,2,0|1,0,0]=3 1256 B8R1.7 C=C(C)C1=CC=CS1 MCULE-1440811307 [0,0,0,0,2,0|1,1,0]=4 1257 B8R1.7 CC(=C1C=CC=C1)C MCULE-1513653645 [0,0,0,0,2,0|2,0,0]=4 1258 B8R1.7 CC(=C1C=CC=C1)O MCULE-1295162717 [0,0,0,0,2,0|1,0,1]=4 1259 B8R1.7 CC(=C1C=CC=C1)O MCULE-5249133210 [0,0,0,0,2,0|1,0,1]=4 1260 B8R1.7 CC(=O)C1=CC=CN1 MCULE-8111376055 [0,0,0,0,2,0|1,0,0]=3 1261 B8R1.7 CC(=O)C1=CC=CO1 MCULE-6389695813 [0,0,0,0,2,0|0,0,0]=2 1262 B8R1.7 CC(=O)C1=CC=CS1 MCULE-7771755380 [0,0,0,0,2,0|0,1,0]=3 1263 B8R1.7 CC(=O)C1=CC=NO1 MCULE-6400530220 [0,0,0,0,2,0|1,0,0]=3 1264 B8R1.7 CC(=O)C1=CC=NO1 MCULE-7437421488 [0,0,0,0,2,0|1,0,0]=3 1265 B8R1.7 CC(=O)C1=CC=NS1 MCULE-6790489481 [0,0,0,0,2,0|1,1,0]=4 1266 B8R1.7 CC(=O)C1=CN=CO1 MCULE-6114499046 [0,0,0,0,2,0|1,0,0]=3 1267 B8R1.7 CC(=O)C1=CN=CS1 MCULE-5771579983 [0,0,0,0,2,0|1,1,0]=4 1268 B8R1.7 CC(=O)C1=CNC=C1 MCULE-6298298881 [0,0,0,0,2,0|2,0,0]=4 1269 B8R1.7 CC(=O)C1=CNC=N1 MCULE-1707621771 [0,0,0,0,2,0|2,0,0]=4 1270 B8R1.7 CC(=O)C1=CNC=N1 MCULE-5046690186 [0,0,0,0,2,0|2,0,0]=4 1271 B8R1.7 CC(=O)C1=COC=C1 MCULE-5791648334 [0,0,0,0,2,0|2,0,0]=4 1272 B8R1.7 CC(=O)C1=COC=N1 MCULE-4496552775 [0,0,0,0,2,0|2,0,0]=4 1273 B8R1.7 CC(=O)C1=CSC=C1 MCULE-3092440506 [0,0,0,0,2,0|2,0,0]=4 1274 B8R1.7 CC(=O)C1=CSC=N1 MCULE-4510751071 [0,0,0,0,2,0|2,0,0]=4 1275 B8R1.7 CC(=O)C1=C[Se]C=C1 MCULE-3604526457 [0,0,0,0,2,0|2,0,0]=4 1276 B8R1.7 CC(=O)C1=NC=CN1 MCULE-5563475674 [0,0,0,0,2,0|2,0,0]=4 1277 B8R1.7 CC(=O)C1=NC=CN1 MCULE-8301653421 [0,0,0,0,2,0|2,0,0]=4 1278 B8R1.7 CC(=O)C1=NC=CO1 MCULE-4439017055 [0,0,0,0,2,0|1,0,0]=3 1279 B8R1.7 CC(=O)C1=NC=CS1 MCULE-8609457131 [0,0,0,0,2,0|1,1,0]=4 1280 B8R1.7 CC(=O)C1=NNC=C1 MCULE-1764885364 [0,0,0,0,2,0|2,0,0]=4 1281 B8R1.7 CC(=O)C1=NNC=C1 MCULE-2223319558 [0,0,0,0,2,0|2,0,0]=4 1282 B8R1.7 CC(=O)C1=NOC=C1 MCULE-5515132953 [0,0,0,0,2,0|2,0,0]=4 1283 B8R1.7 CC(=O)C1=NSC=C1 MCULE-3804368348 [0,0,0,0,2,0|2,0,0]=4 1284 B8R1.7 CC(=O)N1C=CC=N1 MCULE-4064811074 [0,0,0,0,2,0|2,0,0]=4 1285 B8R1.7 CC(C)C1=CC=CO1 MCULE-5006919612 [0,0,0,0,2,0|1,0,1]=4 1286 B8R1.7 CC(N)C1=CC=CO1 MCULE-6881825521 [0,0,0,0,2,0|1,0,1]=4 1287 B8R1.7 CC(N)C1=CC=CO1 MCULE-9729112122 [0,0,0,0,2,0|1,0,1]=4 1288 B8R1.7 CC(O)C1=CC=CO1 MCULE-3593974083 [0,0,0,0,2,0|0,0,2]=4 1289 B8R1.7 CC(O)C1=CC=CO1 MCULE-8955975517 [0,0,0,0,2,0|0,0,2]=4 1290 B8R1.7 CC(S)C1=CC=CO1 MCULE-2817020417 [0,0,0,0,2,0|0,1,1]=4 1291 B8R1.7 C[C@@H](N)C1=CC=CO1 MCULE-4442301514 [0,0,0,0,2,0|1,0,1]=4 1292 B8R1.7 C[C@@H](N)C1=CC=CO1 MCULE-4568819554 [0,0,0,0,2,0|1,0,1]=4 1293 B8R1.7 C[C@@H](N)C1=CC=CO1 MCULE-6015348077 [0,0,0,0,2,0|1,0,1]=4 1294 B8R1.7 C[C@@H](N)C1=CC=CO1 MCULE-8752089038 [0,0,0,0,2,0|1,0,1]=4 1295 B8R1.7 C[C@@H](O)C1=CC=CO1 MCULE-3160995315 [0,0,0,0,2,0|0,0,2]=4 1296 B8R1.7 C[C@@H](O)C1=CC=CO1 MCULE-5913992407 [0,0,0,0,2,0|0,0,2]=4 1297 B8R1.7 C[C@H](N)C1=CC=CO1 MCULE-5162994771 [0,0,0,0,2,0|1,0,1]=4 1298 B8R1.7 C[C@H](N)C1=CC=CO1 MCULE-6401390630 [0,0,0,0,2,0|1,0,1]=4 1299 B8R1.7 C[C@H](N)C1=CC=CO1 MCULE-7687564009 [0,0,0,0,2,0|1,0,1]=4 1300 B8R1.7 C[C@H](N)C1=CC=CO1 MCULE-9994511303 [0,0,0,0,2,0|1,0,1]=4 1301 B8R1.7 C[C@H](O)C1=CC=CO1 MCULE-4636464749 [0,0,0,0,2,0|0,0,2]=4 1302 B8R1.7 N=C(N)C1=CC=CO1 MCULE-1625490857 [0,0,0,0,2,0|2,0,0]=4 1303 B8R1.7 N=C(N)C1=CC=CO1 MCULE-4196389982 [0,0,0,0,2,0|2,0,0]=4 1304 B8R1.7 NC(=O)C1=CC=CN1 MCULE-4462347914 [0,0,0,0,2,0|2,0,0]=4 1305 B8R1.7 NC(=O)C1=CC=CO1 MCULE-1387924424 [0,0,0,0,2,0|1,0,0]=3 1306 B8R1.7 NC(=O)C1=CC=CS1 MCULE-2370255848 [0,0,0,0,2,0|1,1,0]=4 1307 B8R1.7 NC(=O)C1=CC=NO1 MCULE-2775036033 [0,0,0,0,2,0|2,0,0]=4 1308 B8R1.7 NC(=O)C1=CN=CO1 MCULE-1434757715 [0,0,0,0,2,0|2,0,0]=4 1309 B8R1.7 NC(=O)C1=NC=CO1 MCULE-7785358369 [0,0,0,0,2,0|2,0,0]=4 1310 B8R1.7 NC(=S)C1=CC=CO1 MCULE-6700283664 [0,0,0,0,2,0|1,1,0]=4 1311 B8R1.7 O=C(Cl)C1=CC=CN1 MCULE-7026539670 [0,0,0,0,2,0|2,0,0]=4 1312 B8R1.7 O=C(Cl)C1=CC=CO1 MCULE-3397677348 [0,0,0,0,2,0|1,0,0]=3 1313 B8R1.7 O=C(Cl)C1=CC=CS1 MCULE-9726042533 [0,0,0,0,2,0|1,1,0]=4 1314 B8R1.7 O=C(Cl)C1=CC=NO1 MCULE-4921347925 [0,0,0,0,2,0|2,0,0]=4 1315 B8R1.7 O=C(Cl)C1=CN=CO1 MCULE-8427544910 [0,0,0,0,2,0|2,0,0]=4 1316 B8R1.7 O=C(O)C1=CC=CN1 MCULE-4915329170 [0,0,0,0,2,0|2,0,0]=4 1317 B8R1.7 O=C(O)C1=CC=CO1 MCULE-5132845727 [0,0,0,0,2,0|1,0,0]=3 1318 B8R1.7 O=C(O)C1=CC=CS1 MCULE-4461858345 [0,0,0,0,2,0|1,1,0]=4 1319 B8R1.7 O=C(O)C1=CC=C[Se]1 MCULE-9543908979 [0,0,0,0,2,0|1,1,0]=4 1320 B8R1.7 O=C(O)C1=CC=NO1 MCULE-4061809739 [0,0,0,0,2,0|2,0,0]=4 1321 B8R1.7 O=C(O)C1=CN=CO1 MCULE-9125638838 [0,0,0,0,2,0|2,0,0]=4 1322 B8R1.7 O=C(O)C1=NC=CO1 MCULE-3527449990 [0,0,0,0,2,0|2,0,0]=4 1323 B8R1.7 O=C([O-])C1=CC=CO1 MCULE-6949656709 [0,0,0,0,2,0|1,0,0]=3 1324 B8R1.7 O=C([O-])C1=CC=CO1 MCULE-9985902220 [0,0,0,0,2,0|1,0,0]=3 1325 B8R1.7 O=C([O-])C1=CC=CS1 MCULE-8307938812 [0,0,0,0,2,0|1,1,0]=4 1326 B8R1.7 O=C([O-])C1=NC=CO1 MCULE-3161815399 [0,0,0,0,2,0|2,0,0]=4 1327 B8R1.7 O=N(=O)C1=CC=CO1 MCULE-8301724234 [0,0,0,0,2,0|2,0,0]=4 1328 B10R1.17 C=C/C=C/C1=CC=CC=C1 MCULE-3834167572 [1,0,0,0,0,1|1,0,1]=4 1329 B10R1.17 C=CC=CC1=CC=CC=C1 MCULE-8642939786 [1,0,0,0,0,1|1,0,1]=4 1330 B10R1.17 CCC=CC1=CC=CC=C1 MCULE-4221162087 [1,0,0,0,0,1|1,0,1]=4 1331 B10R1.17 O=C/C=C/C1=CC=CC=C1 MCULE-5082013471 [1,0,0,0,0,1|1,0,0]=3 1332 B10R1.17 O=CC=CC1=CC=CC=C1 MCULE-9193590445 [1,0,0,0,0,1|1,0,0]=3 1333 B10R1.17 O=CC=CC1=CC=NC=C1 MCULE-1183611355 [1,0,0,0,0,1|1,0,0]=3 1334 B10R1.17 O=CC=CC1=CC=NC=C1 MCULE-7484037361 [1,0,0,0,0,1|1,0,0]=3 1335 B10R1.17 O=CC=CC1=NC=CC=C1 MCULE-3993450342 [1,0,0,0,0,1|1,0,0]=3 1336 B12R1.252 CC(=CC=CC1=CC=CC=C1)C MCULE-5833999233 [0,0,0,0,0,2|2,0,0]=4 1337 B12R1.252 CC(=O)/C=C/NC1=CC=CC=C1 MCULE-3845007734 [0,0,0,0,0,2|1,0,0]=3 1338 B12R1.252 CC(=O)/C=N/NC1=CC=CC=C1 MCULE-5921354185 [0,0,0,0,0,2|2,0,0]=4 1339 B12R1.252 CC(=O)C=CNC1=CC=CC=C1 MCULE-8741762191 [0,0,0,0,0,2|1,0,0]=3 1340 B12R1.252 CC(=O)C=CSC1=CC=CC=C1 MCULE-3075772886 [0,0,0,0,0,2|1,0,0]=3 1341 B12R1.252 CC(=O)C=NNC1=CC=CC=C1 MCULE-7716405419 [0,0,0,0,0,2|2,0,0]=4 1342 B12R1.252 CC(=O)NN=CC1=CC=CC=C1 MCULE-9609012278 [0,0,0,0,0,2|2,0,0]=4 1343 B12R1.252 CC(=O)NN=CC1=CC=NC=C1 MCULE-9329820707 [0,0,0,0,0,2|2,0,0]=4 1344 B12R1.252 CC(=O)NN=CC1=CN=CC=C1 MCULE-4211906627 [0,0,0,0,0,2|2,0,0]=4 1345 B12R1.252 CC(=O)NN=CC1=NC=CC=C1 MCULE-1958936132 [0,0,0,0,0,2|2,0,0]=4 1346 B12R1.252 O=C(O)C/C=C/C1=CC=CC=C1 MCULE-5944027373 [0,0,0,0,0,2|2,0,0]=4 1347 B12R1.252 O=C(O)C=CCC1=CC=CC=C1 MCULE-5534408884 [0,0,0,0,0,2|2,0,0]=4 1348 B12R1.252 O=C(O)C=CSC1=CC=CC=C1 MCULE-6409148074 [0,0,0,0,0,2|2,0,0]=4 1349 B12R1.252 O=C(O)CC=CC1=CC=CC=C1 MCULE-4504838602 [0,0,0,0,0,2|2,0,0]=4 1350 B12R1.252 O=C([O-])C=CSC1=CC=CC=C1 MCULE-6287638624 [0,0,0,0,0,2|2,0,0]=4 1351 B12R1.255 CC(=CCNCC1=CC=CO1)Cl MCULE-2783783119 [0,0,0,0,0,2|1,0,1]=4 1352 B12R1.255 CC(=CCNCC1=CC=CO1)Cl MCULE-5841805839 [0,0,0,0,0,2|1,0,1]=4 1353 B12R1.255 O=C(O)/C=C/C=C/C1=CC=CO1 MCULE-5819744840 [0,0,0,0,0,2|1,0,0]=3 1354 B12R1.255 O=C(O)C=CC=CC1=CC=CO1 MCULE-1193873530 [0,0,0,0,0,2|1,0,0]=3 1355 B12R1.255 O=C(O)C=CSCC1=CC=CO1 MCULE-4132561770 [0,0,0,0,0,2|1,0,0]=3 1356 B12R1.255 O=C(O)CON=CC1=CC=CO1 MCULE-3611216709 [0,0,0,0,0,2|1,0,1]=4