0 B12R2.612 B1(C2=C(CO1)C=C(C=C2)F)O A125782 [0,0,0,0,0,0|3,1,0]=4 1 B12R2.612 B1(C2=C(CO1)C=C(C=C2)F)O A422141 [0,0,0,0,0,0|3,1,0]=4 2 B12R2.612 C1=C(C2=CN=C(N=C2N1)Cl)Br B171870 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.612 C1=C(C=NC2=C1NC=C2I)Br B188679 [0,0,0,0,0,0|3,1,0]=4 4 B12R2.612 C1=C(C=NC2=C1NN=C2N)Br B166524 [0,0,0,0,0,0|2,1,0]=3 5 B12R2.612 C1=CC2=C(C=C1Br)NN=C2N A184357 [0,0,0,0,0,0|1,1,0]=2 6 B12R2.612 C1=CC2=C(C=C1Br)ON=C2N B182182 [0,0,0,0,0,0|2,1,0]=3 7 B12R2.612 C1=CC2=C(C=C1Cl)ON=C2Cl D191321 [0,0,0,0,0,0|2,0,0]=2 8 B12R2.612 C1=CC2=C(C=C1F)NNC2=O D412511 [0,0,0,0,0,0|0,1,2]=3 9 B12R2.612 C1C(=O)C2=C(O1)C=C(C=C2)F C356422 [0,0,0,0,0,0|2,1,1]=4 10 B12R2.612 C1C(=O)C2=C(O1)C=C(C=C2)O H139103 [0,0,0,0,0,0|3,0,1]=4 11 B12R2.612 C1C2=C(C=CC(=C2)Br)C(=O)N1 B138992 [0,0,0,0,0,0|1,1,2]=4 12 B12R2.612 C1C2=C(C=CC(=C2)Br)C(=O)O1 B133970 [0,0,0,0,0,0|2,1,1]=4 13 B12R2.612 C1C2=C(C=CC(=C2)Cl)C(=O)N1 C194866 [0,0,0,0,0,0|1,0,2]=3 14 B12R2.612 C1C2=C(C=CC(=C2)Cl)C(=O)O1 C185101 [0,0,0,0,0,0|2,0,1]=3 15 B12R2.612 C1C2=C(C=CC(=C2)F)C(=O)N1 F586841 [0,0,0,0,0,0|1,1,2]=4 16 B12R2.612 C1C2=C(C=CC(=C2)F)C(=O)O1 F186112 [0,0,0,0,0,0|2,1,1]=4 17 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)N1 A175776 [0,0,0,0,0,0|2,0,2]=4 18 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)O1 A479320 [0,0,0,0,0,0|3,0,1]=4 19 B12R2.612 C1C2=C(C=CC(=C2)O)C(=O)O1 H589460 [0,0,0,0,0,0|3,0,1]=4 20 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)Br B103113 [0,0,0,0,0,0|2,1,1]=4 21 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)Cl C107757 [0,0,0,0,0,0|2,0,1]=3 22 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)F F123321 [0,0,0,0,0,0|2,1,1]=4 23 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)I I342342 [0,0,0,0,0,0|2,1,1]=4 24 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)O H103118 [0,0,0,0,0,0|3,0,1]=4 25 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl C489567 [0,0,0,0,0,0|3,0,1]=4 26 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl R489596 [0,0,0,0,0,0|3,0,1]=4 27 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl S489584 [0,0,0,0,0,0|3,0,1]=4 28 B12R2.612 C1CC2=C(C1O)C=CC(=C2)Br B588810 [0,0,0,0,0,0|2,1,1]=4 29 B12R2.612 CC1=C2C=CC(=CC2=NN1)Br B177425 [0,0,0,0,0,0|1,1,2]=4 30 B12R2.612 CC1=C2C=CC(=CC2=NN1)F F587463 [0,0,0,0,0,0|1,1,2]=4 31 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M123329 [0,0,0,0,0,0|3,0,1]=4 32 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 M194482 [0,0,0,0,0,0|2,0,2]=4 33 B12R2.612 CC1=CNC2=C1C=CC(=C2)Br B172675 [0,0,0,0,0,0|2,1,0]=3 34 B12R2.612 CC1=NOC2=C1C=CC(=C2)Br B480791 [0,0,0,0,0,0|2,1,0]=3 35 B12R2.612 CN1C2=C(C=C(C=C2)Br)C=N1 B176539 [0,0,0,0,0,0|3,1,0]=4 36 B11R2.1 B1(C2=CC=CC=C2CO1)O H340686 [1,0,0,0,0,0|3,0,0]=4 37 B11R2.1 C1=CC2=C(C(=CN2)Br)N=C1 B588326 [1,0,0,0,0,0|3,0,0]=4 38 B11R2.1 C1=CC2=C(N=C1)N(N=N2)O H109328 [1,0,0,0,0,0|2,0,1]=4 39 B11R2.1 C1=CC2=C(N=C1)ON=C2N I341284 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.1 C1=CC2=C(NC=C2Br)N=C1 B122919 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.1 C1=CC2=C(NC=C2Cl)N=C1 C177499 [1,0,0,0,0,0|3,0,0]=4 42 B11R2.1 C1=CC2=C(NC=C2I)N=C1 I122921 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.1 C1=CC2=C(NN=C2C=C1)Br B589034 [1,0,0,0,0,0|1,0,2]=4 44 B11R2.1 C1=CC2=C(NN=C2C=C1)Cl C169319 [1,0,0,0,0,0|1,0,2]=4 45 B11R2.1 C1=CC2=C(NNC2=O)N=C1 H192577 [1,0,0,0,0,0|1,0,2]=4 46 B11R2.1 C1=CC2=NN=C(N2C=C1)N T136869 [1,0,0,0,0,0|2,0,1]=4 47 B11R2.1 C1=CC=C2C(=C1)C(=CO2)Br B194097 [1,0,0,0,0,0|3,0,0]=4 48 B11R2.1 C1=CC=C2C(=C1)C(=CS2)Br B189193 [1,0,0,0,0,0|3,0,0]=4 49 B11R2.1 C1=CC=C2C(=C1)C(=NN2)N A134463 [1,0,0,0,0,0|1,0,0]=2 50 B11R2.1 C1=CC=C2C(=C1)C(=NO2)Cl C181887 [1,0,0,0,0,0|2,0,0]=3 51 B11R2.1 C1=CC=C2C(=C1)C(=NS2)Cl C134023 [1,0,0,0,0,0|2,0,0]=3 52 B11R2.1 C1=CC=C2C(=C1)C(=O)NN2 H134010 [1,0,0,0,0,0|0,0,2]=3 53 B11R2.1 C1=CC=C2C(=C1)C(=O)NO2 B138497 [1,0,0,0,0,0|1,0,2]=4 54 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B107479 [1,0,0,0,0,0|1,0,2]=4 55 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B406425 [1,0,0,0,0,0|1,0,2]=4 56 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B598939 [1,0,0,0,0,0|1,0,2]=4 57 B11R2.1 C1=CC=C2C(=C1)N=NN2N A151238 [1,0,0,0,0,0|2,0,1]=4 58 B11R2.1 C1=CC=C2C(=C1)N=NN2O H106176 [1,0,0,0,0,0|1,0,1]=3 59 B11R2.1 C1=CC=C2C(=C1)N=NN2O H304220 [1,0,0,0,0,0|1,0,1]=3 60 B11R2.1 C1=CN=CC2=C1NC=C2Br B588316 [1,0,0,0,0,0|3,0,0]=4 61 B11R2.1 C1C(=O)C2=CC=CC=C2O1 B119781 [1,0,0,0,0,0|2,0,1]=4 62 B11R2.1 C1C2=CC=CC=C2C(=O)N1 I170551 [1,0,0,0,0,0|1,0,2]=4 63 B11R2.1 C1C2=CC=CC=C2C(=O)O1 P104476 [1,0,0,0,0,0|2,0,1]=4 64 B11R2.1 C1CC(=O)C2=CC=CC=C21 I106436 [1,0,0,0,0,0|2,0,1]=4 65 B11R2.1 C1CC(=O)C2=CC=CC=C21 I426156 [1,0,0,0,0,0|2,0,1]=4 66 B11R2.1 C1CC2=CC=CC=C2C1O H157335 [1,0,0,0,0,0|2,0,1]=4 67 B11R2.1 C1CC2=CC=CC=C2C1O H419517 [1,0,0,0,0,0|2,0,1]=4 68 B11R2.1 C1CC2=CC=CC=C2C1O H592262 [1,0,0,0,0,0|2,0,1]=4 69 B11R2.1 CC1=CNC2=CC=CC=C12 M426157 [1,0,0,0,0,0|2,0,0]=3 70 B11R2.1 CC1=CNC2=CC=CC=C12 S104736 [1,0,0,0,0,0|2,0,0]=3 71 B11R2.1 CC1=CSC2=CC=CC=C12 M101861 [1,0,0,0,0,0|3,0,0]=4 72 B11R2.1 CC1CNC2=CC=CC=C12 M589123 [1,0,0,0,0,0|2,0,1]=4 73 B11R2.1 CN1C2=CC=CC=C2N=N1 M158121 [1,0,0,0,0,0|2,0,1]=4 74 B11R2.36 C1=C(C=NC2=C1NN=C2)Br B138056 [1,0,0,0,0,0|1,1,0]=3 75 B11R2.36 C1=C(N=C2C(=N1)C=NN2)Cl C586838 [1,0,0,0,0,0|2,0,0]=3 76 B11R2.36 C1=C2C(=CN=C1Br)C=NN2 B166507 [1,0,0,0,0,0|1,1,0]=3 77 B11R2.36 C1=C2C=NNC2=NC=C1Cl C180498 [1,0,0,0,0,0|3,0,0]=4 78 B11R2.36 C1=CC(=CC2=C1C=CN2)Br B123498 [1,0,0,0,0,0|1,1,0]=3 79 B11R2.36 C1=CC(=CC2=C1C=CN2)Cl C123500 [1,0,0,0,0,0|1,0,0]=2 80 B11R2.36 C1=CC(=CC2=C1C=CN2)F F111471 [1,0,0,0,0,0|1,1,0]=3 81 B11R2.36 C1=CC(=CC2=C1C=CN2)N A119320 [1,0,0,0,0,0|2,0,0]=3 82 B11R2.36 C1=CC(=CC2=C1C=CN2)O H102255 [1,0,0,0,0,0|2,0,0]=3 83 B11R2.36 C1=CC(=CC2=C1C=CO2)Br B173227 [1,0,0,0,0,0|2,1,0]=4 84 B11R2.36 C1=CC(=CC2=C1C=CO2)N B586369 [1,0,0,0,0,0|3,0,0]=4 85 B11R2.36 C1=CC(=CC2=C1C=CS2)Br B133149 [1,0,0,0,0,0|2,1,0]=4 86 B11R2.36 C1=CC(=NC2=C1C=CN2)Br B181491 [1,0,0,0,0,0|2,1,0]=4 87 B11R2.36 C1=CC(=NC2=C1C=CN2)Cl C176770 [1,0,0,0,0,0|2,0,0]=3 88 B11R2.36 C1=CC(=NC2=C1C=CN2)F F195689 [1,0,0,0,0,0|2,1,0]=4 89 B11R2.36 C1=CC(=NC2=C1NN=C2)Cl C178379 [1,0,0,0,0,0|3,0,0]=4 90 B11R2.36 C1=CC(=O)NC2=C1C=CN2 H589458 [1,0,0,0,0,0|3,0,0]=4 91 B11R2.36 C1=CC2=C(C=C1Br)C=NN2 B122429 [1,0,0,0,0,0|2,1,0]=4 92 B11R2.36 C1=CC2=C(C=C1Br)C=NN2 B589198 [1,0,0,0,0,0|2,1,0]=4 93 B11R2.36 C1=CC2=C(C=C1Br)NC=N2 B137245 [1,0,0,0,0,0|2,1,0]=4 94 B11R2.36 C1=CC2=C(C=C1Br)NN=C2 B152362 [1,0,0,0,0,0|0,1,0]=2 95 B11R2.36 C1=CC2=C(C=C1Cl)C=NN2 C186101 [1,0,0,0,0,0|2,0,0]=3 96 B11R2.36 C1=CC2=C(C=C1Cl)N=CO2 C167876 [1,0,0,0,0,0|2,0,1]=4 97 B11R2.36 C1=CC2=C(C=C1Cl)N=CS2 C192496 [1,0,0,0,0,0|2,0,1]=4 98 B11R2.36 C1=CC2=C(C=C1Cl)NC=N2 C153428 [1,0,0,0,0,0|2,0,0]=3 99 B11R2.36 C1=CC2=C(C=C1Cl)NN=C2 C177222 [1,0,0,0,0,0|0,0,0]=1 100 B11R2.36 C1=CC2=C(C=C1Cl)OC=N2 C182978 [1,0,0,0,0,0|3,0,0]=4 101 B11R2.36 C1=CC2=C(C=C1F)C=NN2 F169766 [1,0,0,0,0,0|2,1,0]=4 102 B11R2.36 C1=CC2=C(C=C1F)NC=N2 F191875 [1,0,0,0,0,0|2,1,0]=4 103 B11R2.36 C1=CC2=C(C=C1I)NC=N2 I195064 [1,0,0,0,0,0|2,1,0]=4 104 B11R2.36 C1=CC2=C(C=C1I)NN=C2 I157583 [1,0,0,0,0,0|0,1,0]=2 105 B11R2.36 C1=CC2=C(C=C1N)C=NN2 A113923 [1,0,0,0,0,0|3,0,0]=4 106 B11R2.36 C1=CC2=C(C=C1N)NC=N2 A151159 [1,0,0,0,0,0|3,0,0]=4 107 B11R2.36 C1=CC2=C(C=C1N)NC=N2 H332116 [1,0,0,0,0,0|3,0,0]=4 108 B11R2.36 C1=CC2=C(C=C1N)NN=C2 A110323 [1,0,0,0,0,0|1,0,0]=2 109 B11R2.36 C1=CC2=C(C=C1O)C=NN2 H122402 [1,0,0,0,0,0|3,0,0]=4 110 B11R2.36 C1=CC2=C(C=C1O)NN=C2 H157135 [1,0,0,0,0,0|1,0,0]=2 111 B11R2.36 C1=CC2=C(C=CN2)C=C1Cl C119122 [1,0,0,0,0,0|3,0,0]=4 112 B11R2.36 C1=CC2=C(C=CS2)C=C1Cl C135346 [1,0,0,0,0,0|3,0,0]=4 113 B11R2.36 C1=CC2=CSN=C2C=C1Br B343921 [1,0,0,0,0,0|1,1,1]=4 114 B11R2.36 C1=CC2=NNN=C2C=C1Cl C153445 [1,0,0,0,0,0|1,0,2]=4 115 B11R2.36 C1=CC2=NNN=C2C=C1Cl C586524 [1,0,0,0,0,0|1,0,2]=4 116 B11R2.36 C1=CN2C=CN=C2C=C1Cl C176512 [1,0,0,0,0,0|2,0,1]=4 117 B11R2.36 C1=CNC2=C1N=CC(=C2)Br B139476 [1,0,0,0,0,0|2,1,0]=4 118 B11R2.36 C1=CNC2=C1N=CC(=C2)Cl C586160 [1,0,0,0,0,0|2,0,0]=3 119 B11R2.36 C1=CNC2=C1N=CC(=C2)I I165431 [1,0,0,0,0,0|2,1,0]=4 120 B11R2.36 C1=CNC2=NC(=NC=C21)Cl C176164 [1,0,0,0,0,0|3,0,0]=4 121 B11R2.36 C1CNC2=C1C=CC(=C2)Cl D303889 [1,0,0,0,0,0|1,0,1]=3 122 B11R2.36 C1CNC2=C1C=CC(=C2)F F303147 [1,0,0,0,0,0|1,1,1]=4 123 B11R2.36 CC1=CC2=C(C=C1)C=CN2 M107953 [1,0,0,0,0,0|2,0,0]=3 124 B11R2.36 CC1=CC2=C(C=C1)N=CN2 M158013 [1,0,0,0,0,0|3,0,0]=4 125 B11R2.36 CC1=CC2=C(C=C1)NN=C2 M121870 [1,0,0,0,0,0|3,0,0]=4 126 B11R2.36 CC1=NC2=C(C=C1)C=CN2 M195188 [1,0,0,0,0,0|3,0,0]=4 127 B13R2.662 C1=CC(=NC2=C1C(=CN2)C=O)Cl C193119 [0,1,0,0,0,0|2,0,1]=4 128 B13R2.662 C1=CC2=C(C=C1Br)NC=C2C=O B122978 [0,1,0,0,0,0|1,1,1]=4 129 B13R2.662 C1=CC2=C(C=C1F)NC=C2C=O F588543 [0,1,0,0,0,0|1,1,1]=4 130 B13R2.5187 C1=CC2=C(C=C1Cl)C(=O)OC2=O C153925 [0,1,0,0,0,0|2,0,1]=4 131 B13R2.5187 CN1C2=C(C=CC(=C2)Br)C(=N1)N B180188 [0,1,0,0,0,0|1,1,0]=3 132 B13R2.5190 C1=CC2=C(C=C1Br)NC(=O)C2=O B124372 [0,1,0,0,0,0|1,1,1]=4 133 B13R2.5190 C1=CC2=C(C=C1Cl)NC(=O)C2=O C136451 [0,1,0,0,0,0|1,0,1]=3 134 B13R2.5190 C1=CC2=C(C=C1F)NC(=O)C2=O F183689 [0,1,0,0,0,0|1,1,1]=4 135 B13R2.11642 C1CC(=O)C2=C1C=C(C=C2Cl)Cl D469228 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.22 C1=CC(=CC=C1C(=NO)N)Br E182421 [0,0,1,0,0,0|2,1,0]=4 137 B11R1.22 C1=CC(=CC=C1C(=NO)N)Cl C589284 [0,0,1,0,0,0|2,0,0]=3 138 B11R1.22 C1=CC(=CC=C1C(=NO)N)F F472588 [0,0,1,0,0,0|2,1,0]=4 139 B11R1.22 C1=CC(=CC=C1C(=NO)N)N A169216 [0,0,1,0,0,0|3,0,0]=4 140 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Cl B135176 [0,0,1,0,0,0|2,0,1]=4 141 B11R1.22 C1=CC(=CC=C1C(=O)CN)Br A136664 [0,0,1,0,0,0|1,1,1]=4 142 B11R1.22 C1=CC(=CC=C1C(=O)CN)F A184615 [0,0,1,0,0,0|1,1,1]=4 143 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br B152172 [0,0,1,0,0,0|0,1,2]=4 144 B11R1.22 C1=CC(=CC=C1C(=O)NN)Cl C153811 [0,0,1,0,0,0|0,0,2]=3 145 B11R1.22 C1=CC(=CC=C1C(=O)NN)F F156619 [0,0,1,0,0,0|0,1,2]=4 146 B11R1.22 C1=CC(=CC=C1C(=O)NN)N A151536 [0,0,1,0,0,0|1,0,2]=4 147 B11R1.22 C1=CC(=CC=C1C(=O)NN)O H106356 [0,0,1,0,0,0|1,0,2]=4 148 B11R1.22 C1=CC(=CC=C1C(CN)O)O O101521 [0,0,1,0,0,0|2,0,1]=4 149 B11R1.22 CC(=NO)C1=CC=C(C=C1)O H157119 [0,0,1,0,0,0|3,0,0]=4 150 B11R1.22 CC1=CC=C(C=C1)C(=NO)N M168234 [0,0,1,0,0,0|3,0,0]=4 151 B11R1.22 CC1=CC=C(C=C1)C(=O)NN M158580 [0,0,1,0,0,0|1,0,2]=4 152 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl C109480 [0,0,1,0,0,0|2,0,1]=4 153 B11R1.22 COC(=O)C1=CC=C(C=C1)Cl M158002 [0,0,1,0,0,0|2,0,1]=4 154 B11R1.22 NCC(O)C1=CC=C(O)C=C1 O408184 [0,0,1,0,0,0|2,0,1]=4 155 B11R1.24 C1=CC(=CC(=C1)Cl)CCC=O C167090 [0,0,1,0,0,0|2,0,1]=4 156 B11R1.37 COC1=C(C=CC(=C1)Cl)C=O C193805 [0,0,1,0,0,0|2,0,1]=4 157 B11R1.37 COC1=C(C=CC(=C1)Cl)CO C350374 [0,0,1,0,0,0|2,0,1]=4 158 B11R1.166 B(C1=C(C=C(C=C1)Cl)Br)(O)O B587282 [0,0,1,0,0,0|3,0,0]=4 159 B11R1.166 B(C1=C(C=C(C=C1)Cl)C)(O)O C138468 [0,0,1,0,0,0|3,0,0]=4 160 B11R1.166 B(C1=C(C=C(C=C1)Cl)Cl)(O)O D100730 [0,0,1,0,0,0|3,0,0]=4 161 B11R1.166 B(C1=C(C=C(C=C1)Cl)F)(O)O C102614 [0,0,1,0,0,0|3,0,0]=4 162 B11R1.166 C1=C(C(=CN=C1Cl)C(=O)O)Br B586817 [0,0,1,0,0,0|3,0,0]=4 163 B11R1.166 C1=C(C(=CN=C1Cl)C(=O)O)Cl D177300 [0,0,1,0,0,0|3,0,0]=4 164 B11R1.166 C1=C(C=NC(=C1N)C(=O)O)Br A139363 [0,0,1,0,0,0|2,1,0]=4 165 B11R1.166 C1=C(C=NC(=C1N)C(=O)O)Br A174412 [0,0,1,0,0,0|2,1,0]=4 166 B11R1.166 C1=CC(=C(C=C1Br)Br)C(=O)O D123768 [0,0,1,0,0,0|2,1,0]=4 167 B11R1.166 C1=CC(=C(C=C1Br)Br)C(=O)O D154849 [0,0,1,0,0,0|2,1,0]=4 168 B11R1.166 C1=CC(=C(C=C1Br)Cl)C(=O)O B152314 [0,0,1,0,0,0|2,1,0]=4 169 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O B152368 [0,0,1,0,0,0|2,1,0]=4 170 B11R1.166 C1=CC(=C(C=C1Br)I)C(=O)O B586421 [0,0,1,0,0,0|2,1,0]=4 171 B11R1.166 C1=CC(=C(C=C1Br)N)C(=O)O A120954 [0,0,1,0,0,0|1,1,0]=3 172 B11R1.166 C1=CC(=C(C=C1Br)O)C(=O)O B111419 [0,0,1,0,0,0|2,1,0]=4 173 B11R1.166 C1=CC(=C(C=C1Cl)Br)C(=O)O B139463 [0,0,1,0,0,0|2,0,0]=3 174 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)Cl D100633 [0,0,1,0,0,0|2,0,1]=4 175 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)N D154877 [0,0,1,0,0,0|1,0,2]=4 176 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)O D104404 [0,0,1,0,0,0|2,0,0]=3 177 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)O D104405 [0,0,1,0,0,0|2,0,0]=3 178 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=S)N B301192 [0,0,1,0,0,0|1,1,1]=4 179 B11R1.166 C1=CC(=C(C=C1Cl)F)C(=O)O C120446 [0,0,1,0,0,0|2,0,0]=3 180 B11R1.166 C1=CC(=C(C=C1Cl)I)C(=O)O C123922 [0,0,1,0,0,0|2,0,0]=3 181 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)N A185419 [0,0,1,0,0,0|0,0,2]=3 182 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)O A101215 [0,0,1,0,0,0|1,0,0]=2 183 B11R1.166 C1=CC(=C(C=C1Cl)N)[N+](=O)[O-] C122530 [0,0,1,0,0,0|2,0,1]=4 184 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O C123920 [0,0,1,0,0,0|2,0,0]=3 185 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O B120666 [0,0,1,0,0,0|2,1,0]=4 186 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)O C120960 [0,0,1,0,0,0|2,1,0]=4 187 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)O D124500 [0,0,1,0,0,0|2,1,0]=4 188 B11R1.166 C1=CC(=C(C=C1F)I)C(=O)O F120989 [0,0,1,0,0,0|2,1,0]=4 189 B11R1.166 C1=CC(=C(C=C1F)N)C(=O)O F156606 [0,0,1,0,0,0|1,1,0]=3 190 B11R1.166 C1=CC(=C(C=C1F)O)C(=O)O F133808 [0,0,1,0,0,0|2,1,0]=4 191 B11R1.166 C1=CC(=C(C=C1I)Br)C(=O)O B491580 [0,0,1,0,0,0|2,1,0]=4 192 B11R1.166 C1=CC(=C(C=C1I)Cl)C(=O)O C153752 [0,0,1,0,0,0|2,1,0]=4 193 B11R1.166 C1=CC(=C(C=C1I)O)C(=O)O H167820 [0,0,1,0,0,0|2,1,0]=4 194 B11R1.166 C1=CC(=C(C=C1N)Cl)C(=O)O A123909 [0,0,1,0,0,0|3,0,0]=4 195 B11R1.166 C1=CC(=C(C=C1N)F)C(=O)O A120664 [0,0,1,0,0,0|3,0,0]=4 196 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O A105007 [0,0,1,0,0,0|3,0,0]=4 197 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O P337788 [0,0,1,0,0,0|3,0,0]=4 198 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O P422509 [0,0,1,0,0,0|3,0,0]=4 199 B11R1.166 C1=CC(=C(C=C1O)Br)C(=O)O B588568 [0,0,1,0,0,0|3,0,0]=4 200 B11R1.166 C1=CC(=C(C=C1O)Cl)C(=O)O C123874 [0,0,1,0,0,0|3,0,0]=4 201 B11R1.166 C1=CC(=C(C=C1O)F)C(=O)O F123925 [0,0,1,0,0,0|3,0,0]=4 202 B11R1.166 C1=CC(=C(C=C1O)O)C(=O)O D104371 [0,0,1,0,0,0|3,0,0]=4 203 B11R1.166 C1=CC(=NC(=C1C(=O)O)Cl)Cl D124303 [0,0,1,0,0,0|3,0,0]=4 204 B11R1.166 C1=CC(=NC(=C1C(=O)O)F)Cl C586617 [0,0,1,0,0,0|3,0,0]=4 205 B11R1.166 C1=CC(=NC(=C1C(=O)O)N)Cl A469400 [0,0,1,0,0,0|2,0,0]=3 206 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)N A190249 [0,0,1,0,0,0|1,1,1]=4 207 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Br B186775 [0,0,1,0,0,0|2,0,1]=4 208 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl D132842 [0,0,1,0,0,0|2,0,1]=4 209 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)F C182148 [0,0,1,0,0,0|2,0,1]=4 210 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O C153948 [0,0,1,0,0,0|2,0,1]=4 211 B11R1.166 CC(C1=C(C=C(C=C1)Cl)Cl)O D155730 [0,0,1,0,0,0|2,0,1]=4 212 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)O B152290 [0,0,1,0,0,0|2,1,0]=4 213 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)C C588908 [0,0,1,0,0,0|2,0,1]=4 214 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)O C123923 [0,0,1,0,0,0|2,0,0]=3 215 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O F156728 [0,0,1,0,0,0|2,1,0]=4 216 B11R1.166 CC1=C(C=CC(=C1)I)C(=O)O L573533 [0,0,1,0,0,0|2,1,0]=4 217 B11R1.166 CC1=C(C=CC(=C1)N)C(=O)O A133080 [0,0,1,0,0,0|3,0,0]=4 218 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)O H139023 [0,0,1,0,0,0|3,0,0]=4 219 B11R1.166 CC1=C(C=CC(=N1)Cl)C(=O)O C181344 [0,0,1,0,0,0|3,0,0]=4 220 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Br B123862 [0,0,1,0,0,0|3,0,0]=4 221 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C D101977 [0,0,1,0,0,0|3,0,0]=4 222 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Cl C186521 [0,0,1,0,0,0|3,0,0]=4 223 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F F120565 [0,0,1,0,0,0|3,0,0]=4 224 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)N A151592 [0,0,1,0,0,0|2,0,0]=3 225 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O M111847 [0,0,1,0,0,0|3,0,0]=4 226 B11R1.166 CC1=CC(=NC=C1C(=O)O)Cl C346007 [0,0,1,0,0,0|3,0,0]=4 227 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)N A177594 [0,0,1,0,0,0|3,0,0]=4 228 B13R2.3683 C1=CC(=CC2=CNC(=O)C=C21)Cl C586499 [0,0,0,0,0,1|1,0,2]=4 229 B13R2.3683 C1=CC2=C(C=C1Cl)N=CC(=O)N2 C183094 [0,0,0,0,0,1|1,0,2]=4 230 B13R2.3683 C1=CC2=C(C=CC(=C2)Br)C=C1O B120300 [0,0,0,0,0,1|2,1,0]=4 231 B13R2.3683 C1=CC2=C(C=CC(=C2)O)C=C1O D156012 [0,0,0,0,0,1|3,0,0]=4 232 B13R2.3683 C1=CC2=C(C=CC(=N2)Cl)C=C1Cl W135314 [0,0,0,0,0,1|3,0,0]=4 233 B13R2.3683 C1=CC2=C(C=CC(=N2)Cl)C=C1Cl W615693 [0,0,0,0,0,1|3,0,0]=4 234 B13R2.3683 C1=CC2=NC(=CN=C2C=C1Cl)Cl D123526 [0,0,0,0,0,1|2,0,1]=4 235 B13R2.3683 C1CC(=O)NC2=C1C=C(C=C2)Cl C182436 [0,0,0,0,0,1|2,0,1]=4 236 B13R2.3683 CC1=NC2=C(C=C1)C=C(C=C2)Cl C153508 [0,0,0,0,0,1|3,0,0]=4 237 B13R2.5179 C1=CC2=C(C=C1Br)NC=CC2=O W133604 [0,0,0,0,0,1|1,1,1]=4 238 B13R2.5179 C1=CC2=C(C=C1Cl)C=NNC2=O C176849 [0,0,0,0,0,1|1,0,1]=3 239 B13R2.5179 C1=CC2=C(C=C1Cl)N=CN=C2Cl W137108 [0,0,0,0,0,1|1,0,1]=3 240 B13R2.5179 C1=CC2=C(C=C1Cl)N=CNC2=O C189104 [0,0,0,0,0,1|0,0,3]=4 241 B13R2.5179 C1=CC2=C(C=C1Cl)NC=CC2=O C124656 [0,0,0,0,0,1|1,0,1]=3 242 B13R2.5179 C1=CC2=C(C=C1F)NC=CC2=O F170091 [0,0,0,0,0,1|1,1,1]=4 243 B13R2.5179 C1=CC2=C(C=CC(=C2)Br)C(=C1)O B590694 [0,0,0,0,0,1|2,1,0]=4 244 B13R2.5179 C1=CC2=C(C=CC(=C2)O)C(=C1)O D154708 [0,0,0,0,0,1|3,0,0]=4 245 B13R2.5179 C1=CC2=C(C=CN=C2C=C1Cl)Br B196146 [0,0,0,0,0,1|2,0,1]=4 246 B13R2.5179 C1=CC2=C(C=CN=C2C=C1Cl)Cl D155356 [0,0,0,0,0,1|2,0,1]=4 247 B13R2.5179 C1=CC2=C(C=CN=C2C=C1Cl)I C469927 [0,0,0,0,0,1|2,0,1]=4 248 B13R2.5179 C1=CC2=C(C=CN=C2C=C1Cl)N A166386 [0,0,0,0,0,1|2,0,1]=4 249 B13R2.5179 C1=CC2=C(C=CN=C2Cl)C=C1Br B182635 [0,0,0,0,0,1|2,1,0]=4 250 B13R2.5179 C1=CC2=C(C=CN=C2Cl)C=C1Cl D589726 [0,0,0,0,0,1|2,0,0]=3 251 B13R2.5179 C1=CC2=C(C=CN=C2Cl)C=C1F C588123 [0,0,0,0,0,1|2,1,0]=4 252 B13R2.5179 C1CC2=C(C=CC(=C2)Cl)C(=O)C1 C154069 [0,0,0,0,0,1|2,0,1]=4 253 B13R2.5179 C1COC2=C(C1=O)C=CC(=C2)Cl C182282 [0,0,0,0,0,1|2,0,1]=4 254 B13R2.5179 CC1=CC2=C(C=C1)C(=O)C=CN2 M337111 [0,0,0,0,0,1|2,0,1]=4 255 B10R1.1 C1=CC(=CC=C1CCN)Cl C153968 [1,0,1,0,0,0|1,0,1]=4 256 B10R1.1 C1=CC(=CC=C1CCN)Cl C493551 [1,0,1,0,0,0|1,0,1]=4 257 B10R1.13 B(C1=CC=C(C=C1)Cl)(O)O C103544 [1,0,1,0,0,0|2,0,0]=4 258 B10R1.13 B(C1=CC=C(C=C1)Cl)(O)O C396376 [1,0,1,0,0,0|2,0,0]=4 259 B10R1.13 C1=CC(=CC=C1C(=N)N)Br B140178 [1,0,1,0,0,0|1,1,0]=4 260 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl C153625 [1,0,1,0,0,0|1,0,0]=3 261 B10R1.13 C1=CC(=CC=C1C(=N)N)F F140179 [1,0,1,0,0,0|1,1,0]=4 262 B10R1.13 C1=CC(=CC=C1C(=N)N)N A113930 [1,0,1,0,0,0|2,0,0]=4 263 B10R1.13 C1=CC(=CC=C1C(=N)N)O H121877 [1,0,1,0,0,0|2,0,0]=4 264 B10R1.13 C1=CC(=CC=C1C(=O)Cl)Cl C106079 [1,0,1,0,0,0|1,0,1]=4 265 B10R1.13 C1=CC(=CC=C1C(=O)N)Br B133990 [1,0,1,0,0,0|0,1,1]=4 266 B10R1.13 C1=CC(=CC=C1C(=O)N)Cl C153725 [1,0,1,0,0,0|0,0,1]=3 267 B10R1.13 C1=CC(=CC=C1C(=O)N)F F109724 [1,0,1,0,0,0|0,1,1]=4 268 B10R1.13 C1=CC(=CC=C1C(=O)N)I I135499 [1,0,1,0,0,0|0,1,1]=4 269 B10R1.13 C1=CC(=CC=C1C(=O)N)N A107276 [1,0,1,0,0,0|1,0,1]=4 270 B10R1.13 C1=CC(=CC=C1C(=O)N)O H157094 [1,0,1,0,0,0|1,0,1]=4 271 B10R1.13 C1=CC(=CC=C1C(=O)O)Br B104344 [1,0,1,0,0,0|1,1,0]=4 272 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C104333 [1,0,1,0,0,0|1,0,0]=3 273 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C104334 [1,0,1,0,0,0|1,0,0]=3 274 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C433417 [1,0,1,0,0,0|1,0,0]=3 275 B10R1.13 C1=CC(=CC=C1C(=O)O)F F105088 [1,0,1,0,0,0|1,1,0]=4 276 B10R1.13 C1=CC(=CC=C1C(=O)O)F F105089 [1,0,1,0,0,0|1,1,0]=4 277 B10R1.13 C1=CC(=CC=C1C(=O)O)I I105098 [1,0,1,0,0,0|1,1,0]=4 278 B10R1.13 C1=CC(=CC=C1C(=O)O)N A108862 [1,0,1,0,0,0|2,0,0]=4 279 B10R1.13 C1=CC(=CC=C1C(=O)O)N A108863 [1,0,1,0,0,0|2,0,0]=4 280 B10R1.13 C1=CC(=CC=C1C(=O)O)N A421766 [1,0,1,0,0,0|2,0,0]=4 281 B10R1.13 C1=CC(=CC=C1C(=O)O)N A432150 [1,0,1,0,0,0|2,0,0]=4 282 B10R1.13 C1=CC(=CC=C1C(=O)O)O H108508 [1,0,1,0,0,0|2,0,0]=4 283 B10R1.13 C1=CC(=CC=C1C(=O)O)O H108509 [1,0,1,0,0,0|2,0,0]=4 284 B10R1.13 C1=CC(=CC=C1C(=O)O)O P427231 [1,0,1,0,0,0|2,0,0]=4 285 B10R1.13 C1=CC(=CC=C1C(=O)O)S M100780 [1,0,1,0,0,0|2,0,0]=4 286 B10R1.13 C1=CC(=CC=C1C(=O)O)S M431355 [1,0,1,0,0,0|2,0,0]=4 287 B10R1.13 C1=CC(=CC=C1C(=S)N)Br B140152 [1,0,1,0,0,0|0,2,0]=4 288 B10R1.13 C1=CC(=CC=C1C(=S)N)Cl C140150 [1,0,1,0,0,0|0,1,0]=3 289 B10R1.13 C1=CC(=CC=C1C(=S)N)O H101894 [1,0,1,0,0,0|1,1,0]=4 290 B10R1.13 C1=CC(=NC=C1C(=O)N)Cl C154058 [1,0,1,0,0,0|1,0,1]=4 291 B10R1.13 C1=CC(=NC=C1C(=O)O)Cl C128115 [1,0,1,0,0,0|2,0,0]=4 292 B10R1.13 C1=CC(=NC=C1Cl)C(=O)O C137081 [1,0,1,0,0,0|2,0,0]=4 293 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl C103870 [1,0,1,0,0,0|1,0,1]=4 294 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C111118 [1,0,1,0,0,0|1,0,1]=4 295 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C171312 [1,0,1,0,0,0|1,0,1]=4 296 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C185668 [1,0,1,0,0,0|1,0,1]=4 297 B10R1.13 CC(C1=CC=C(C=C1)Cl)N R588512 [1,0,1,0,0,0|1,0,1]=4 298 B10R1.13 CC(C1=CC=C(C=C1)Cl)O C153305 [1,0,1,0,0,0|1,0,1]=4 299 B10R1.13 CC(C1=CC=C(C=C1)Cl)O S196166 [1,0,1,0,0,0|1,0,1]=4 300 B10R1.13 CC1=CC=C(C=C1)C(=N)N M135239 [1,0,1,0,0,0|2,0,0]=4 301 B10R1.13 CC1=CC=C(C=C1)C(=O)N P160467 [1,0,1,0,0,0|1,0,1]=4 302 B10R1.13 CC1=CC=C(C=C1)C(=O)O T104320 [1,0,1,0,0,0|2,0,0]=4 303 B10R1.13 CC1=CC=C(C=C1)C(=O)O T119535 [1,0,1,0,0,0|2,0,0]=4 304 B10R1.13 CC1=CC=C(C=C1)C(=O)O T305431 [1,0,1,0,0,0|2,0,0]=4 305 B10R1.13 CC1=CC=C(C=C1)C(=S)N M140148 [1,0,1,0,0,0|1,1,0]=4 306 B10R1.15 C1=CC=C(C=C1)C(=NO)N B139085 [1,0,1,0,0,0|2,0,0]=4 307 B10R1.15 C1=CC=C(C=C1)C(=O)CN A123237 [1,0,1,0,0,0|1,0,1]=4 308 B10R1.15 C1=CC=C(C=C1)C(=O)NN B104697 [1,0,1,0,0,0|0,0,2]=4 309 B10R1.15 C1=CC=C(C=C1)C(CN)O A102440 [1,0,1,0,0,0|1,0,1]=4 310 B10R1.15 C1=CC=C(C=C1)C(CN)O A151123 [1,0,1,0,0,0|1,0,1]=4 311 B10R1.15 C1=CC=C(C=C1)C(CN)O R138565 [1,0,1,0,0,0|1,0,1]=4 312 B10R1.15 CC(=NO)C1=CC=CC=C1 A151383 [1,0,1,0,0,0|2,0,0]=4 313 B10R1.15 CC(=NO)C1=CC=CC=C1 A467913 [1,0,1,0,0,0|2,0,0]=4 314 B10R1.10 C1=CC(=CC(=C1)Cl)CCO C153312 [1,0,1,0,0,0|1,0,1]=4 315 B10R1.10 C1=CC(=CC(=C1)Cl)N=C=O C107899 [1,0,1,0,0,0|0,0,2]=4 316 B10R1.10 C1=CC(=CC(=C1)Cl)N=C=S C140586 [1,0,1,0,0,0|0,1,1]=4 317 B10R1.17 C1=CC=C(C=C1)NCCO N140440 [1,0,1,0,0,0|1,0,1]=4 318 B10R1.17 C=CCNC1=CC=CC=C1 N159240 [1,0,1,0,0,0|2,0,0]=4 319 B10R1.20 CNC1=CC=CC=C1C=O M195023 [1,0,1,0,0,0|1,0,1]=4 320 B10R1.25 C1=C(C(=CN=C1Cl)C=O)N A586085 [1,0,1,0,0,0|1,0,1]=4 321 B10R1.25 C1=CC(=C(C=C1Br)N)CO A188537 [1,0,1,0,0,0|0,1,1]=4 322 B10R1.25 C1=CC(=C(C=C1Cl)Br)C=O B177580 [1,0,1,0,0,0|1,0,1]=4 323 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C=O D100690 [1,0,1,0,0,0|1,0,1]=4 324 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D154151 [1,0,1,0,0,0|1,0,1]=4 325 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D422163 [1,0,1,0,0,0|1,0,1]=4 326 B10R1.25 C1=CC(=C(C=C1Cl)F)C=O C120609 [1,0,1,0,0,0|1,0,1]=4 327 B10R1.25 C1=CC(=C(C=C1Cl)F)CO C185242 [1,0,1,0,0,0|1,0,1]=4 328 B10R1.25 C1=CC(=C(C=C1Cl)N)C#N A133325 [1,0,1,0,0,0|0,0,2]=4 329 B10R1.25 C1=CC(=C(C=C1Cl)N)CO A169996 [1,0,1,0,0,0|0,0,1]=3 330 B10R1.25 C1=CC(=C(C=C1Cl)O)C=O C140242 [1,0,1,0,0,0|1,0,1]=4 331 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O C193235 [1,0,1,0,0,0|1,0,1]=4 332 B10R1.25 CC1=C(C=CC(=C1)Cl)CO C153314 [1,0,1,0,0,0|1,0,1]=4 333 B10R1.25 CNC1=C(C=C(C=C1)Cl)N C194119 [1,0,1,0,0,0|2,0,0]=4 334 B10R1.25 COC1=C(C=C(C=C1)Cl)N C153904 [1,0,1,0,0,0|2,0,0]=4 335 B10R1.30 C1=CC(=C(C=C1Cl)C#N)O C419962 [1,0,1,0,0,0|1,0,1]=4 336 B10R1.30 C1=CC(=C(C=C1Cl)C=O)O C109465 [1,0,1,0,0,0|2,0,0]=4 337 B10R1.30 C1=CC(=C(C=C1Cl)CO)O C170839 [1,0,1,0,0,0|2,0,0]=4 338 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl D102571 [1,0,1,0,0,0|1,0,1]=4 339 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl D169429 [1,0,1,0,0,0|1,0,1]=4 340 B10R1.30 COC1=C(C=CC(=C1)Cl)O C153525 [1,0,1,0,0,0|2,0,0]=4 341 B10R1.61 B(C1=CC=CC=C1N)(O)O A120509 [1,0,1,0,0,0|2,0,0]=4 342 B10R1.61 B(C1=CC=CC=C1N)(O)O A137630 [1,0,1,0,0,0|2,0,0]=4 343 B10R1.61 C1=CC(=C(N=C1)C(=O)O)N A174297 [1,0,1,0,0,0|2,0,0]=4 344 B10R1.61 C1=CC(=C(N=C1)N)C(=O)O A107211 [1,0,1,0,0,0|2,0,0]=4 345 B10R1.61 C1=CC=C(C(=C1)C(=N)N)Br B589518 [1,0,1,0,0,0|2,0,0]=4 346 B10R1.61 C1=CC=C(C(=C1)C(=O)N)N A107203 [1,0,1,0,0,0|0,0,2]=4 347 B10R1.61 C1=CC=C(C(=C1)C(=O)O)Br B108507 [1,0,1,0,0,0|2,0,0]=4 348 B10R1.61 C1=CC=C(C(=C1)C(=O)O)Cl C112608 [1,0,1,0,0,0|2,0,0]=4 349 B10R1.61 C1=CC=C(C(=C1)C(=O)O)F F156750 [1,0,1,0,0,0|2,0,0]=4 350 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I I105094 [1,0,1,0,0,0|2,0,0]=4 351 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S104158 [1,0,1,0,0,0|2,0,0]=4 352 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S104162 [1,0,1,0,0,0|2,0,0]=4 353 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S118533 [1,0,1,0,0,0|2,0,0]=4 354 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S128322 [1,0,1,0,0,0|2,0,0]=4 355 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S425578 [1,0,1,0,0,0|2,0,0]=4 356 B10R1.61 C1=CC=C(C(=C1)C(=O)O)S T104175 [1,0,1,0,0,0|2,0,0]=4 357 B10R1.61 C1=CC=C(C(=C1)C(=O)O)[O-] A589374 [1,0,1,0,0,0|2,0,0]=4 358 B10R1.61 C1=CN=CC(=C1C(=O)O)N A151502 [1,0,1,0,0,0|2,0,0]=4 359 B10R1.61 C1=CN=CC(=C1N)C(=O)O A129122 [1,0,1,0,0,0|2,0,0]=4 360 B10R1.61 CC(=C)C1=CC=CC=C1N I170789 [1,0,1,0,0,0|2,0,0]=4 361 B10R1.61 CC(=O)C1=CC=CC=C1N A107199 [1,0,1,0,0,0|1,0,1]=4 362 B10R1.61 CC(=O)C1=CC=CC=C1N A123238 [1,0,1,0,0,0|1,0,1]=4 363 B10R1.61 CC(C1=CC=CC=C1N)O A405641 [1,0,1,0,0,0|1,0,1]=4 364 B10R1.61 CC1=CC=CC=C1C(=O)O O420836 [1,0,1,0,0,0|2,0,0]=4 365 B10R1.61 CC1=CC=CC=C1C(=O)O T104307 [1,0,1,0,0,0|2,0,0]=4 366 B10R1.61 OC(=O)C1=CC=CC=C1O S408836 [1,0,1,0,0,0|2,0,0]=4 367 B10R2.7 C1=CC2=C(C=CN2)N=C1 H135749 [2,0,0,0,0,0|2,0,0]=4 368 B10R2.7 C1=CC2=C(C=NN2)N=C1 I169192 [2,0,0,0,0,0|1,0,0]=3 369 B10R2.7 C1=CC2=C(NC=C2)N=C1 A124841 [2,0,0,0,0,0|2,0,0]=4 370 B10R2.7 C1=CC2=C(NN=C2)N=C1 P123108 [2,0,0,0,0,0|1,0,0]=3 371 B10R2.7 C1=CC2=CN=CN2C=C1 I157599 [2,0,0,0,0,0|2,0,0]=4 372 B10R2.7 C1=CC2=CON=C2C=C1 A151655 [2,0,0,0,0,0|1,0,1]=4 373 B10R2.7 C1=CC2=NN=CN2C=C1 T192477 [2,0,0,0,0,0|1,0,1]=4 374 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104724 [2,0,0,0,0,0|1,0,0]=3 375 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104725 [2,0,0,0,0,0|1,0,0]=3 376 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104726 [2,0,0,0,0,0|1,0,0]=3 377 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104728 [2,0,0,0,0,0|1,0,0]=3 378 B10R2.7 C1=CC=C2C(=C1)C=CN2 I420909 [2,0,0,0,0,0|1,0,0]=3 379 B10R2.7 C1=CC=C2C(=C1)C=CO2 B107470 [2,0,0,0,0,0|2,0,0]=4 380 B10R2.7 C1=CC=C2C(=C1)C=CS2 B107023 [2,0,0,0,0,0|2,0,0]=4 381 B10R2.7 C1=CC=C2C(=C1)C=NN2 I157585 [2,0,0,0,0,0|0,0,0]=2 382 B10R2.7 C1=CC=C2C(=C1)C=NO2 B151955 [2,0,0,0,0,0|1,0,0]=3 383 B10R2.7 C1=CC=C2C(=C1)N=NS2 B491199 [2,0,0,0,0,0|1,0,1]=4 384 B10R2.7 C1=CC=C2C(=C1)NC=N2 B106095 [2,0,0,0,0,0|2,0,0]=4 385 B10R2.7 C1=CN=CC2=C1C=NN2 I169188 [2,0,0,0,0,0|1,0,0]=3 386 B10R2.7 C1=CN=CC2=C1NN=C2 I169189 [2,0,0,0,0,0|1,0,0]=3 387 B10R2.7 C1=CNC2=C1C=CN=C2 A140209 [2,0,0,0,0,0|2,0,0]=4 388 B10R2.7 C1=CNC2=C1C=NC=C2 P120087 [2,0,0,0,0,0|2,0,0]=4 389 B10R2.7 C1C=CC2=CC=CC=C21 I105567 [2,0,0,0,0,0|2,0,0]=4 390 B10R2.7 C1C=CC2=CC=CC=C21 I105568 [2,0,0,0,0,0|2,0,0]=4 391 B10R2.7 C1C=CC2=CC=CC=C21 I105569 [2,0,0,0,0,0|2,0,0]=4 392 B10R2.7 C1CNC2=CC=CC=C21 I103557 [2,0,0,0,0,0|1,0,1]=4 393 B12R1.367 C1=CC(=C(C=C1C(=O)NN)Cl)Cl D303318 [0,1,1,0,0,0|0,0,2]=4 394 B12R1.1703 C1=CC(=C(C=C1Cl)Cl)C(=O)NN D155069 [0,1,1,0,0,0|0,0,2]=4 395 B12R1.226 C1=CC(=CC(=C1)Cl)C=CC(=O)O C101735 [0,1,1,0,0,0|2,0,0]=4 396 B12R1.226 C1=CC(=CC(=C1)Cl)C=CC(=O)O C485689 [0,1,1,0,0,0|2,0,0]=4 397 B12R1.226 C1=CC(=CC(=C1)Cl)CCC(=O)O C132834 [0,1,1,0,0,0|2,0,0]=4 398 B12R1.226 C1=CC(=CC(=C1)Cl)OCC(=O)O C185405 [0,1,1,0,0,0|2,0,0]=4 399 B12R1.57 COC1=C(C=CC(=C1)Cl)C(=O)O C153817 [0,1,1,0,0,0|2,0,0]=4 400 B12R1.232 C1=C(C(=CC(=C1Br)Cl)F)C(=O)O B192550 [0,1,1,0,0,0|2,0,0]=4 401 B12R1.232 C1=C(C(=CC(=C1Br)F)N)C(=O)O A181503 [0,1,1,0,0,0|1,1,0]=4 402 B12R1.232 C1=C(C(=CC(=C1Cl)Cl)N)C(=O)O A182678 [0,1,1,0,0,0|1,0,0]=3 403 B12R1.232 C1=C(C(=CC(=C1F)Cl)Cl)C(=O)O D123769 [0,1,1,0,0,0|2,0,0]=4 404 B12R1.232 C1=C(C(=CC(=C1F)Cl)F)C(=O)O W132118 [0,1,1,0,0,0|2,0,0]=4 405 B12R1.232 C1=C(C(=CC(=C1F)F)N)C(=O)O A120663 [0,1,1,0,0,0|1,1,0]=4 406 B12R1.232 CC1=CC(=C(C=C1C)N)C(=O)O A151593 [0,1,1,0,0,0|2,0,0]=4 407 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)N A123844 [0,1,1,0,0,0|2,0,0]=4 408 B12R1.893 C1=CC(=C(C(=C1C(=O)O)F)F)Cl C191069 [0,1,1,0,0,0|2,0,0]=4 409 B12R1.893 C1=CC(=C(C(=C1C(=O)O)N)F)Br A174048 [0,1,1,0,0,0|1,1,0]=4 410 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)N)C A101740 [0,1,1,0,0,0|2,0,0]=4 411 B12R1.893 CC1=C(C=CC(=C1N)C(=O)O)Br A586931 [0,1,1,0,0,0|1,1,0]=4 412 B12R1.1000 C1=C(C=C(C(=C1Cl)C(=O)O)Cl)Cl T119953 [0,1,1,0,0,0|2,0,0]=4 413 B12R1.1000 C1=C(C=C(C(=C1F)C(=O)O)F)Cl C587942 [0,1,1,0,0,0|2,0,0]=4 414 B12R1.1000 C1=C(C=C(C(=C1N)C(=O)O)Cl)Cl A478820 [0,1,1,0,0,0|1,0,0]=3 415 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C#N C123502 [1,1,0,0,0,0|2,0,0]=4 416 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C=O I106884 [1,1,0,0,0,0|1,0,1]=4 417 B12R2.1 C1=CC=C2C(=C1)C(=CN2)CO I105220 [1,1,0,0,0,0|1,0,0]=3 418 B12R2.1 C1=CC=C2C(=C1)C(=NO2)CBr B588941 [1,1,0,0,0,0|2,0,0]=4 419 B12R2.1 C1CC(=NO)C2=CC=CC=C21 I169661 [1,1,0,0,0,0|2,0,0]=4 420 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I104664 [1,1,0,0,0,0|1,0,1]=4 421 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I104665 [1,1,0,0,0,0|1,0,1]=4 422 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I426911 [1,1,0,0,0,0|1,0,1]=4 423 B12R2.18 CC1=C(NC2=CC=CC=C12)C D103560 [1,1,0,0,0,0|2,0,0]=4 424 B12R2.132 C1=CC2=C(C=C1Br)C(=NN2)N B589649 [1,1,0,0,0,0|1,0,0]=3 425 B12R2.132 C1=CC2=C(C=C1Cl)N(N=N2)O C109318 [1,1,0,0,0,0|1,0,1]=4 426 B12R2.132 CC1=CNC2=C1C=C(C=C2)Br B131931 [1,1,0,0,0,0|2,0,0]=4 427 B12R2.132 CC1=CNC2=C1C=C(C=C2)F F405736 [1,1,0,0,0,0|2,0,0]=4 428 B12R2.132 CC1=NOC2=C1C=C(C=C2)Br B480593 [1,1,0,0,0,0|2,0,0]=4 429 B12R2.196 C1=CC2=C(C(=C1)Cl)NN=C2N C337084 [1,1,0,0,0,0|1,0,0]=3 430 B12R2.203 C1=CC2=C(C(=C1)Cl)C(=NN2)N C192006 [1,1,0,0,0,0|1,0,0]=3 431 B12R2.203 C1=CC2=C(C(=C1)I)C(=NN2)N I176898 [1,1,0,0,0,0|1,0,0]=3 432 B12R2.203 CC1=CNC2=C1C(=CC=C2)Br B176561 [1,1,0,0,0,0|2,0,0]=4 433 B12R2.2028 C1=CC=C2C(=C1)C(=NC2=N)N W135469 [1,1,0,0,0,0|2,0,0]=4 434 B12R2.2028 CN1C2=CC=CC=C2C(=N1)Br B169582 [1,1,0,0,0,0|1,0,0]=3 435 B12R2.44 C1=CC(=CC2=C1C=CN2)C#N C122963 [1,1,0,0,0,0|2,0,0]=4 436 B12R2.44 C1=CC(=CC2=C1C=CN2)C=O I123428 [1,1,0,0,0,0|2,0,0]=4 437 B12R2.44 C1=CC(=CC2=C1C=CN2)CN A169750 [1,1,0,0,0,0|2,0,0]=4 438 B12R2.44 C1=CC2=C(C=C1C#N)NN=C2 C167208 [1,1,0,0,0,0|1,0,0]=3 439 B12R2.44 C1=CC2=C(C=C1C=O)NN=C2 H139159 [1,1,0,0,0,0|1,0,0]=3 440 B12R2.44 COC1=CC2=C(C=C1)C=CN2 M123429 [1,1,0,0,0,0|2,0,0]=4 441 B12R2.82 CC1=C(C2=C(C=C1)C=NN2)Br B345000 [1,1,0,0,0,0|1,0,0]=3 442 B12R2.82 CC1=C(C=CC2=C1NC=C2)Br B469990 [1,1,0,0,0,0|1,1,0]=4 443 B12R2.100 C1=C2C(=CC(=C1Cl)Cl)N=CN2 D155561 [1,1,0,0,0,0|2,0,0]=4 444 B12R2.100 C1=C2C(=CC(=C1Cl)Cl)N=CN2 D185790 [1,1,0,0,0,0|2,0,0]=4 445 B12R2.100 C1=C2C=NNC2=CC(=C1Br)Cl B173073 [1,1,0,0,0,0|0,0,0]=2 446 B12R2.100 C1=C2C=NNC2=CC(=C1Br)F B171845 [1,1,0,0,0,0|0,1,0]=3 447 B12R2.100 C1=C2C=NNC2=CC(=C1O)Br B172540 [1,1,0,0,0,0|0,1,0]=3 448 B12R2.100 C1=CNC2=CC(=C(C=C21)Br)Cl B172701 [1,1,0,0,0,0|1,0,0]=3 449 B12R2.100 C1=CNC2=CC(=C(C=C21)Cl)Cl D155109 [1,1,0,0,0,0|1,0,0]=3 450 B12R2.100 C1=CNC2=CC(=C(C=C21)F)Br B124806 [1,1,0,0,0,0|1,1,0]=4 451 B12R2.100 C1=CNC2=CC(=C(C=C21)F)Cl C124361 [1,1,0,0,0,0|1,0,0]=3 452 B12R2.100 C1=CNC2=CC(=C(C=C21)O)O D183610 [1,1,0,0,0,0|2,0,0]=4 453 B12R2.100 CC1=CC2=C(C=C1Br)C=NN2 B177926 [1,1,0,0,0,0|1,0,0]=3 454 B12R2.100 CC1=CC2=C(C=C1Br)NN=C2 B586074 [1,1,0,0,0,0|0,1,0]=3 455 B12R2.246 C1=C(C2=C(NN=C2)N=C1Cl)Cl D588099 [1,1,0,0,0,0|1,0,0]=3 456 B12R2.246 C1=C(C=C(C2=C1NN=C2)Br)Cl B177954 [1,1,0,0,0,0|0,0,0]=2 457 B12R2.246 C1=C(C=C(C2=C1NN=C2)F)Br B187690 [1,1,0,0,0,0|0,1,0]=3 458 B12R2.246 C1=C(C=C(C2=C1NN=C2)F)F D177961 [1,1,0,0,0,0|0,1,0]=3 459 B12R2.246 C1=C2C(=C(N=C1Cl)Cl)C=NN2 D586812 [1,1,0,0,0,0|1,0,0]=3 460 B12R2.246 C1=CNC2=C1C(=CC(=N2)Cl)Cl D176881 [1,1,0,0,0,0|2,0,0]=4 461 B12R2.246 C1=CNC2=CC(=CC(=C21)N)Cl C193389 [1,1,0,0,0,0|1,0,0]=3 462 B12R2.246 C1=CNC2=CC(=NC(=C21)Cl)Cl D185934 [1,1,0,0,0,0|2,0,0]=4 463 B12R2.246 C1=NNC2=C1C(=NC(=N2)Cl)Cl D176467 [1,1,0,0,0,0|2,0,0]=4 464 B12R2.246 CC1=CC2=C(C=NN2)C(=C1)F F195570 [1,1,0,0,0,0|1,0,0]=3 465 B12R2.606 C1=CC2=C(C=C1Cl)NC(=O)N2 C168381 [1,1,0,0,0,0|2,0,0]=4 466 B12R2.606 C1=CC2=C(C=C1Cl)NC(=O)O2 C129514 [1,1,0,0,0,0|2,0,0]=4 467 B12R2.606 C1=CC2=C(C=C1Cl)NC(=O)O2 C427066 [1,1,0,0,0,0|2,0,0]=4 468 B12R2.606 C1=CC2=C(C=C1Cl)NC(=O)S2 C132320 [1,1,0,0,0,0|2,0,0]=4 469 B12R2.606 C1=CC2=C(C=C1Cl)NC(=S)N2 C153430 [1,1,0,0,0,0|2,0,0]=4 470 B12R2.606 C1=CC2=C(C=C1Cl)NC(=S)O2 C140285 [1,1,0,0,0,0|2,0,0]=4 471 B12R2.606 C1=CC2=C(C=C1Cl)NC(=S)S2 C136368 [1,1,0,0,0,0|2,0,0]=4 472 B12R2.606 C1C2=C(C=C(C=C2)Cl)NC1=O C124834 [1,1,0,0,0,0|1,0,1]=4 473 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)F F193252 [1,1,0,0,0,0|1,1,0]=4 474 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)Cl C133619 [1,1,0,0,0,0|2,0,0]=4 475 B14R2.8235 C1=CC2=C(C=C1Cl)C(=NC(=N2)Cl)Cl T293981 [0,1,0,0,0,1|2,0,0]=4 476 B14R2.29365 C1=CC2=C(C=C1Cl)N=C(N=C2Cl)Cl T293953 [0,1,0,0,0,1|1,0,1]=4 477 B14R2.29365 C1=CC2=C(C=C1Cl)NC(=O)NC2=O C190547 [0,1,0,0,0,1|0,0,2]=4 478 B14R2.29365 C1=CC2=C(C=C1Cl)NC(=O)OC2=O C119094 [0,1,0,0,0,1|1,0,1]=4 479 B14R2.29365 CC1=CC(=O)C2=C(N1)C=C(C=C2)Cl C338413 [0,1,0,0,0,1|1,0,1]=4 480 B14R2.300 C1=CC2=C(C=C1F)NC=C2C(=O)O F192194 [0,2,0,0,0,0|1,1,0]=4 481 B14R2.300 C1=CC2=C(C=C1F)NN=C2C(=O)O F349218 [0,2,0,0,0,0|0,1,0]=3 482 B14R2.300 CC1=CC2=C(C=C1)C(=CN2)C(=O)O M182719 [0,2,0,0,0,0|2,0,0]=4 483 B14R2.645 C1=C2C(=CC(=C1Cl)Cl)NC(=O)C2=O D191430 [0,2,0,0,0,0|1,0,1]=4 484 B12R2.1081 C1=CC2=C(C=CN=C2)C(=C1)Cl C135973 [0,0,1,1,0,0|2,0,0]=4 485 B12R1.49 C1=CC(=CC=C1NC(=S)NN)Cl C140423 [0,0,1,0,0,1|0,1,1]=4 486 B12R1.233 C1=CC(=C(C=C1Cl)Br)CC(=O)O B184998 [0,0,1,0,0,1|2,0,0]=4 487 B12R1.233 C1=CC(=C(C=C1Cl)Cl)CC(=O)O D113535 [0,0,1,0,0,1|2,0,0]=4 488 B12R1.233 C1=CC(=C(C=C1Cl)F)CC(=O)O C122857 [0,0,1,0,0,1|2,0,0]=4