0 B10R1.58 CC1=C(C=C(S1)C(=O)N)N Z756172860 [0,0,0,0,0,0|3,1,0]=4 1 B10R1.58 CC1=C(C=C(S1)C(=O)O)Br Z1263738666 [0,0,0,0,0,0|1,2,0]=3 2 B10R1.58 CC1=C(N=C(S1)C(=O)O)O Z1216838537 [0,0,0,0,0,0|3,1,0]=4 3 B10R1.58 CC1=C(NC(=C1)C(=O)O)C Z1198334173 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.58 CC1=C(OC(=C1)C(=O)O)Br Z2732856968 [0,0,0,0,0,0|1,1,0]=2 5 B10R1.58 CC1=C(OC(=C1)C(=O)O)C Z1201618976 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.58 CC1=C(SC(=C1)C(=O)O)Br Z1269169628 [0,0,0,0,0,0|1,2,0]=3 7 B10R1.58 CC1=C(SC(=C1)C(=O)O)C Z104492212 [0,0,0,0,0,0|2,1,0]=3 8 B10R1.58 CC1=C(SC(=C1)C(=O)O)Cl Z1198158702 [0,0,0,0,0,0|1,1,0]=2 9 B10R1.58 CC1=CC(=CN1C)C(=O)O Z1726066205 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.58 CC1=NC(=CN1C)C(=O)O Z3033149661 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.58 CN1C=C(NC1=O)C(=O)O Z1205495049 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.58 CN1N=C(C=C1Br)C(=O)O Z1486002914 [0,0,0,0,0,0|3,1,0]=4 13 B10R1.58 CN1N=C(C=C1Cl)C(=O)O Z1255461425 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.58 CN1NC(=CC1=O)C(=O)O Z2236735605 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.58 CN1OC(=CC1=O)C(=O)O Z1824003143 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.58 NC(=O)C1=CC(=C(S1)Br)Br Z33545385 [0,0,0,0,0,0|1,3,0]=4 17 B10R1.58 NC(=O)C1=CC(=C(S1)Br)Cl Z3678519964 [0,0,0,0,0,0|1,2,0]=3 18 B10R1.58 O=C(O)C1=CC(=C(N1)Br)Br Z227972132 [0,0,0,0,0,0|1,2,0]=3 19 B10R1.58 O=C(O)C1=CC(=C(N1)Cl)Br Z419918952 [0,0,0,0,0,0|1,1,0]=2 20 B10R1.58 O=C(O)C1=CC(=C(N1)Cl)Cl Z220588546 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.58 O=C(O)C1=CC(=C(S1)Br)Cl Z419107952 [0,0,0,0,0,0|0,2,0]=2 22 B10R1.58 O=C(O)C1=CC(=C(S1)Cl)Br Z1681338319 [0,0,0,0,0,0|0,2,0]=2 23 B10R1.58 O=C(O)C1=CC(=C(S1)Cl)Cl Z1198171936 [0,0,0,0,0,0|0,1,0]=1 24 B10R1.58 O=C(O)C1=CC(=C(S1)I)Br Z3326509547 [0,0,0,0,0,0|0,3,0]=3 25 B10R1.58 OB(O)C1=CC(=C(S1)Cl)Cl Z1255398536 [0,0,0,0,0,0|1,1,1]=3 26 B9R1.23 CC1=C(C=C(S1)C=O)Br Z1269128772 [1,0,0,0,0,0|1,2,0]=4 27 B9R1.23 CC1=C(OC(=C1)C=O)Br Z1416181300 [1,0,0,0,0,0|1,1,0]=3 28 B9R1.23 CC1=C(OC(=N1)C=O)C Z1404730693 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.23 CC1=C(SC(=C1)C=O)Br Z1259202927 [1,0,0,0,0,0|1,2,0]=4 30 B9R1.23 CC1=C(SC(=C1)C=O)C Z1255488969 [1,0,0,0,0,0|2,1,0]=4 31 B9R1.23 CC1=C(SC(=C1)C=O)Cl Z1255367806 [1,0,0,0,0,0|1,1,0]=3 32 B9R1.23 CN1N=C(C=C1Cl)C=O Z3243520469 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.23 NCC1=CC(=C(S1)Cl)Cl Z3924780398 [1,0,0,0,0,0|1,1,1]=4 34 B9R1.23 O=CC1=CC(=C(N1)Br)Br Z1269193972 [1,0,0,0,0,0|1,2,0]=4 35 B9R1.23 O=CC1=CC(=C(O1)Br)Br Z57887774 [1,0,0,0,0,0|0,2,0]=3 36 B9R1.23 O=CC1=CC(=C(S1)Br)Br Z275127518 [1,0,0,0,0,0|0,3,0]=4 37 B9R1.23 O=CC1=CC(=C(S1)Cl)Br Z1801385217 [1,0,0,0,0,0|0,2,0]=3 38 B9R1.23 O=CC1=CC(=C(S1)Cl)Cl Z1511746512 [1,0,0,0,0,0|0,1,0]=2 39 B9R1.35 CC(=O)C1=CC=C(O1)Br Z147641060 [1,0,0,0,0,0|1,1,0]=3 40 B9R1.35 CC(=O)C1=CC=C(O1)C Z94598638 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.35 CC(=O)C1=CC=C(S1)Br Z56889126 [1,0,0,0,0,0|1,2,0]=4 42 B9R1.35 CC(=O)C1=CC=C(S1)Cl Z56820418 [1,0,0,0,0,0|1,1,0]=3 43 B9R1.35 CC(=O)C1=CN=C(O1)N Z1198261606 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.35 CC(O)C1=CC=C(S1)Cl Z228586148 [1,0,0,0,0,0|1,1,1]=4 45 B9R1.35 CC1=CC(=CN1)C(=O)O Z1198267230 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.35 CC1=CC(=CO1)C(=O)O Z1205493994 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.35 CC1=CC(=CS1)C(=O)O Z979749380 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.35 CC1=CC(=NN1)C(=O)O Z752370868 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.35 CC1=CC=C(O1)C(=N)N Z3235164533 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.35 CC1=CC=C(O1)C(=O)N Z33547151 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.35 CC1=CC=C(O1)C(=O)O Z56895714 [1,0,0,0,0,0|1,0,0]=2 52 B9R1.35 CC1=CC=C(S1)C(=O)O Z104494884 [1,0,0,0,0,0|1,1,0]=3 53 B9R1.35 CC1=CNC(=C1)C(=O)O Z1201622537 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.35 CC1=CNC(=N1)C(=O)O Z2265206911 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.35 CC1=COC(=C1)C(=O)O Z1205494707 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.35 CC1=COC(=N1)C(=O)[O-] Z2938030769 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.35 CC1=CSC(=C1)C(=O)O Z1203160201 [1,0,0,0,0,0|1,1,0]=3 58 B9R1.35 CC1=NC(=CN1)C(=O)O Z969202142 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.35 CC1=NC(=CS1)C(=O)O Z381356522 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.35 CC1=NC=C(S1)C(=O)O Z385373334 [1,0,0,0,0,0|2,1,0]=4 61 B9R1.35 CC1=NOC(=C1)C(=O)O Z90660974 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.35 CC1=NSC(=C1)C(=O)O Z1198313658 [1,0,0,0,0,0|2,1,0]=4 63 B9R1.35 CN1C=CC(=C1)C(=O)O Z1198315029 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.35 CN1C=CC(=N1)C(=O)O Z275170294 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.35 N=C(N)C1=CC=C(S1)Cl Z752371230 [1,0,0,0,0,0|2,1,0]=4 66 B9R1.35 NC(=O)C1=CC(=CN1)N Z1198394173 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.35 NC(=O)C1=CC(=CS1)Br Z274460840 [1,0,0,0,0,0|1,2,0]=4 68 B9R1.35 NC(=O)C1=CC(=CS1)N Z1203653961 [1,0,0,0,0,0|2,1,0]=4 69 B9R1.35 NC(=O)C1=CC=C(O1)Br Z33546653 [1,0,0,0,0,0|1,1,0]=3 70 B9R1.35 NC(=O)C1=CC=C(S1)Br Z33546697 [1,0,0,0,0,0|1,2,0]=4 71 B9R1.35 NC1=NC(=CS1)C(=O)O Z337709420 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.35 NC1=NC=C(O1)C(=O)O Z1198322955 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.35 NC1=NNC(=C1)C(=O)O Z275170588 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.35 O=C(O)C1=CC(=CN1)Cl Z104341138 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.35 O=C(O)C1=CC(=CN1)I Z1183442837 [1,0,0,0,0,0|1,1,0]=3 76 B9R1.35 O=C(O)C1=CC(=CO1)Br Z1198150497 [1,0,0,0,0,0|0,1,0]=2 77 B9R1.35 O=C(O)C1=CC(=CS1)Br Z275128148 [1,0,0,0,0,0|0,2,0]=3 78 B9R1.35 O=C(O)C1=CC(=CS1)F Z1198275133 [1,0,0,0,0,0|0,2,0]=3 79 B9R1.35 O=C(O)C1=CC(=CS1)O Z1157742699 [1,0,0,0,0,0|1,1,0]=3 80 B9R1.35 O=C(O)C1=CC(=NO1)O Z1198180707 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.35 O=C(O)C1=CC=C(N1)Cl Z1205496495 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.35 O=C(O)C1=CC=C(O1)Br Z57233752 [1,0,0,0,0,0|0,1,0]=2 83 B9R1.35 O=C(O)C1=CC=C(O1)Cl Z119989852 [1,0,0,0,0,0|0,0,0]=1 84 B9R1.35 O=C(O)C1=CC=C(O1)F Z1509050307 [1,0,0,0,0,0|0,1,0]=2 85 B9R1.35 O=C(O)C1=CC=C(S1)Br Z56946865 [1,0,0,0,0,0|0,2,0]=3 86 B9R1.35 O=C(O)C1=CC=C(S1)Cl Z56346822 [1,0,0,0,0,0|0,1,0]=2 87 B9R1.35 O=C(O)C1=CC=C(S1)F Z1198175121 [1,0,0,0,0,0|0,2,0]=3 88 B9R1.35 O=C(O)C1=CC=C(S1)I Z1269191681 [1,0,0,0,0,0|0,2,0]=3 89 B9R1.35 O=C(O)C1=CN=C(S1)Br Z1269156140 [1,0,0,0,0,0|1,2,0]=4 90 B9R1.35 O=C(O)C1=CNC(=C1)Br Z1171220840 [1,0,0,0,0,0|2,1,0]=4 91 B9R1.35 O=C(O)C1=CNC(=N1)S Z274566848 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.35 O=C(O)C1=COC(=C1)Br Z255102436 [1,0,0,0,0,0|2,1,0]=4 93 B9R1.35 O=C(O)C1=COC(=C1)Cl Z1255365854 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.35 O=C(O)C1=COC(=N1)Cl Z1198305489 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.35 O=C(O)C1=CSC(=C1)Br Z234969399 [1,0,0,0,0,0|2,1,0]=4 96 B9R1.35 O=C(O)C1=CSC(=C1)Cl Z1198150257 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.35 O=C(O)C1=CSC(=C1)I Z952016278 [1,0,0,0,0,0|2,1,0]=4 98 B9R1.35 O=C(O)C1=CSC(=N1)Cl Z1201625300 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.35 O=C(O)C1=CSC(=N1)S Z1262515699 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.35 O=C(O)C1=NC(=CS1)Br Z1258597092 [1,0,0,0,0,0|1,2,0]=4 101 B9R1.35 O=C(O)C1=NNC(=C1)Br Z1416184726 [1,0,0,0,0,0|2,1,0]=4 102 B9R1.35 O=C1NC(=CS1)C(=O)O Z1205494720 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.35 O=C1NC=C(N1)C(=O)O Z56921827 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.35 O=[N+]([O-])C1=CC=C(S1)Cl Z759291646 [1,0,0,0,0,0|1,1,1]=4 105 B9R1.35 OB(O)C1=CC=C(S1)Cl Z1203161835 [1,0,0,0,0,0|1,1,1]=4 106 B11R1.48 CC1=C(C=C(O1)C(=O)O)CO Z970238464 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.48 CC1=C(C=C(S1)C(=O)O)CN Z3031014633 [0,1,0,0,0,0|2,1,0]=4 108 B11R1.48 CC1=C(NC(=C1)C(=O)O)C#N Z2732459248 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.48 CC1=C(SC(=C1)C(=O)O)C=O Z1201628424 [0,1,0,0,0,0|2,1,0]=4 110 B11R1.48 CCC1=C(C=C(O1)C(=O)O)C Z1262529610 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.48 CCC1=C(C=C(S1)C(=O)O)Br Z1245633690 [0,1,0,0,0,0|1,2,0]=4 112 B11R1.48 CCC1=C(C=C(S1)C(=O)O)C Z90123545 [0,1,0,0,0,0|2,1,0]=4 113 B11R1.48 CCC1=C(SC(=C1)C(=O)O)C Z56347192 [0,1,0,0,0,0|2,1,0]=4 114 B11R1.48 COC1=C(SC(=C1)C(=O)O)Br Z1518607679 [0,1,0,0,0,0|1,2,0]=4 115 B11R1.48 COC1=C(SC(=C1)C(=O)O)Cl Z1262545034 [0,1,0,0,0,0|1,1,0]=3 116 B11R1.48 CSC1=C(OC(=C1)C(=O)O)C Z1192103311 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.48 N#CC1=C(C=C(S1)C(=O)O)Br Z2733317507 [0,1,0,0,0,0|1,2,0]=4 118 B11R1.48 O=CC1=C(OC(=C1)C(=O)O)Cl Z1262531979 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.226 COC(=O)C1=CC(=C(S1)C)N Z802847388 [0,1,0,0,0,0|2,1,0]=4 120 B11R1.226 COC(=O)C1=CC(=C(S1)N)Br Z1269194853 [0,1,0,0,0,0|1,2,0]=4 121 B11R1.672 CC1=C(C(=C(N1)C(=O)O)C)C Z1172170432 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.672 CC1=C(C(=C(S1)C(=O)O)Br)C Z1269241948 [0,1,0,0,0,0|2,1,0]=4 123 B11R1.672 CC1=C(C(=C(S1)C(=O)O)C)Br Z2733339690 [0,1,0,0,0,0|1,2,0]=4 124 B11R1.672 CC1=C(C(=C(S1)C(=O)O)C)C Z1262515566 [0,1,0,0,0,0|2,1,0]=4 125 B11R1.672 CC1=C(SC(=C1Br)Br)C(=O)O Z1862001734 [0,1,0,0,0,0|0,3,0]=4 126 B11R1.672 CC1=C(SC(=C1Br)C(=O)O)Br Z1939451153 [0,1,0,0,0,0|1,2,0]=4 127 B11R1.672 CN1C(=CC(=C1Cl)Cl)C(=O)O Z351482802 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.672 NC1=C(SC(=C1Cl)Cl)C(=O)O Z5326468319 [0,1,0,0,0,0|0,1,0]=2 129 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)Cl Z1269244993 [0,0,0,0,0,1|2,1,0]=4 130 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Br Z1269168018 [0,0,0,0,0,1|2,1,0]=4 131 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl Z104475662 [0,0,0,0,0,1|2,0,0]=3 132 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F Z1201622912 [0,0,0,0,0,1|2,1,0]=4 133 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)N Z979493752 [0,0,0,0,0,1|3,0,0]=4 134 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Cl Z335437578 [0,0,0,0,0,1|2,1,0]=4 135 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,0,0,0,0,1|3,0,0]=4 136 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)C Z1255426822 [0,0,0,0,0,1|3,0,0]=4 137 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)Cl Z1198277843 [0,0,0,0,0,1|2,0,0]=3 138 B11R1.21 CC(O)C1=CC(=C(C=C1)Cl)Cl Z335245002 [0,0,0,0,0,1|2,0,1]=4 139 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Br Z57204180 [0,0,0,0,0,1|2,1,0]=4 140 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C Z104477078 [0,0,0,0,0,1|3,0,0]=4 141 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl Z1097117588 [0,0,0,0,0,1|2,0,0]=3 142 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F Z104510124 [0,0,0,0,0,1|2,1,0]=4 143 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I Z239685220 [0,0,0,0,0,1|2,1,0]=4 144 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)N Z57127001 [0,0,0,0,0,1|3,0,0]=4 145 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.21 CC1=C(C=C(C=N1)C(=O)O)N Z3409985569 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.21 CC1=C(C=C(N=C1)C(=O)O)C Z2894240161 [0,0,0,0,0,1|3,0,0]=4 148 B11R1.21 CC1=C(C=C(N=C1)C(=O)O)Cl Z1255439777 [0,0,0,0,0,1|2,0,0]=3 149 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br Z1269154857 [0,0,0,0,0,1|2,1,0]=4 150 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl Z1201618086 [0,0,0,0,0,1|2,0,0]=3 151 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F Z959335402 [0,0,0,0,0,1|2,1,0]=4 152 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)I Z239685242 [0,0,0,0,0,1|2,1,0]=4 153 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N Z223458490 [0,0,0,0,0,1|3,0,0]=4 154 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O Z995149794 [0,0,0,0,0,1|3,0,0]=4 155 B11R1.21 CC1=C(C=CC(=N1)C(=O)O)Br Z1269158838 [0,0,0,0,0,1|2,1,0]=4 156 B11R1.21 CC1=C(C=NC(=C1)C(=O)O)Cl Z1198173117 [0,0,0,0,0,1|2,0,0]=3 157 B11R1.21 CC1=C(C=NC(=C1)C(=O)O)N Z3397321417 [0,0,0,0,0,1|3,0,0]=4 158 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)Br Z1269114393 [0,0,0,0,0,1|2,1,0]=4 159 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)C Z1198307150 [0,0,0,0,0,1|3,0,0]=4 160 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)Cl Z1255462780 [0,0,0,0,0,1|2,0,0]=3 161 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)F Z1255430474 [0,0,0,0,0,1|2,1,0]=4 162 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)O Z1255445643 [0,0,0,0,0,1|3,0,0]=4 163 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)Br Z1269138133 [0,0,0,0,0,1|2,1,0]=4 164 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)C Z3244908427 [0,0,0,0,0,1|3,0,0]=4 165 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)Cl Z1255381945 [0,0,0,0,0,1|2,0,0]=3 166 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)F Z1198174583 [0,0,0,0,0,1|2,1,0]=4 167 B11R1.21 CC1=C(N=NC(=C1)C(=O)O)Cl Z1813351279 [0,0,0,0,0,1|2,0,0]=3 168 B11R1.21 CC1=CC(=NNC1=O)C(=O)O Z1255427102 [0,0,0,0,0,1|3,0,0]=4 169 B11R1.21 CC1=CNC(=CC1=O)C(=O)O Z1381260939 [0,0,0,0,0,1|3,0,0]=4 170 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055342 [0,0,0,0,0,1|2,0,1]=4 171 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055344 [0,0,0,0,0,1|2,0,1]=4 172 B11R1.21 N=C(N)C1=CC(=C(C=C1)Cl)Cl Z1416282440 [0,0,0,0,0,1|3,0,0]=4 173 B11R1.21 NC(=O)C1=CC(=C(C=C1)Cl)N Z239125304 [0,0,0,0,0,1|3,0,0]=4 174 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,0,0,0,0,1|3,0,0]=4 175 B11R1.21 NC(=O)C1=CC(=C(N=C1)Cl)Br Z1269178981 [0,0,0,0,0,1|2,1,0]=4 176 B11R1.21 NC(=O)C1=CC(=C(N=C1)Cl)Cl Z33546785 [0,0,0,0,0,1|2,0,0]=3 177 B11R1.21 NC(=O)C1=CC(=C(N=C1)N)Cl Z951173228 [0,0,0,0,0,1|3,0,0]=4 178 B11R1.21 NC(=O)C1=NC=C(C(=C1)Cl)Br Z2310130163 [0,0,0,0,0,1|2,1,0]=4 179 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Br Z319214986 [0,0,0,0,0,1|2,1,0]=4 180 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Cl Z1082868852 [0,0,0,0,0,1|2,0,0]=3 181 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)F Z756936498 [0,0,0,0,0,1|2,1,0]=4 182 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)N Z104484514 [0,0,0,0,0,1|3,0,0]=4 183 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [0,0,0,0,0,1|3,0,0]=4 184 B11R1.21 NC1=C(C=C(C=N1)C(=O)O)Br Z1269112095 [0,0,0,0,0,1|2,1,0]=4 185 B11R1.21 NC1=C(C=C(C=N1)C(=O)O)Cl Z330799286 [0,0,0,0,0,1|2,0,0]=3 186 B11R1.21 NC1=C(C=C(C=N1)C(=O)O)O Z3325079213 [0,0,0,0,0,1|3,0,0]=4 187 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Br Z57127000 [0,0,0,0,0,1|2,1,0]=4 188 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Cl Z104478358 [0,0,0,0,0,1|2,0,0]=3 189 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)F Z283856672 [0,0,0,0,0,1|2,1,0]=4 190 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)I Z1079174176 [0,0,0,0,0,1|2,1,0]=4 191 B11R1.21 NC1=C(C=CC(=N1)C(=O)O)Br Z1269123358 [0,0,0,0,0,1|2,1,0]=4 192 B11R1.21 NC1=C(C=CC(=N1)C(=O)O)O Z1198313022 [0,0,0,0,0,1|3,0,0]=4 193 B11R1.21 NC1=C(C=NC(=C1)C(=O)O)Cl Z3379551784 [0,0,0,0,0,1|2,0,0]=3 194 B11R1.21 NC1=C(C=NC(=C1)C(=O)O)F Z3476924546 [0,0,0,0,0,1|2,1,0]=4 195 B11R1.21 NC1=C(N=C(C=C1)C(=O)O)N Z1198311451 [0,0,0,0,0,1|3,0,0]=4 196 B11R1.21 O=C(Cl)C1=CC(=C(N=C1)Cl)Cl Z1269220284 [0,0,0,0,0,1|2,0,0]=3 197 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)Cl Z1269111039 [0,0,0,0,0,1|1,1,0]=3 198 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)F Z756477072 [0,0,0,0,0,1|1,2,0]=4 199 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [0,0,0,0,0,1|2,1,0]=4 200 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Br Z1269180540 [0,0,0,0,0,1|1,1,0]=3 201 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Cl Z104474098 [0,0,0,0,0,1|1,0,0]=2 202 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)F Z636292752 [0,0,0,0,0,1|1,1,0]=3 203 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)I Z239685218 [0,0,0,0,0,1|1,1,0]=3 204 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [0,0,0,0,0,1|2,0,0]=3 205 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Br Z381356490 [0,0,0,0,0,1|1,2,0]=4 206 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Cl Z1203161796 [0,0,0,0,0,1|1,1,0]=3 207 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)F Z104341246 [0,0,0,0,0,1|1,2,0]=4 208 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)I Z1269207858 [0,0,0,0,0,1|1,2,0]=4 209 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [0,0,0,0,0,1|2,1,0]=4 210 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Br Z382582728 [0,0,0,0,0,1|1,2,0]=4 211 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Cl Z1269153522 [0,0,0,0,0,1|1,1,0]=3 212 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)F Z1115194701 [0,0,0,0,0,1|1,2,0]=4 213 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)I Z1269131507 [0,0,0,0,0,1|1,2,0]=4 214 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [0,0,0,0,0,1|2,1,0]=4 215 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Br Z57985393 [0,0,0,0,0,1|2,1,0]=4 216 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Cl Z104503564 [0,0,0,0,0,1|2,0,0]=3 217 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)F Z57073754 [0,0,0,0,0,1|2,1,0]=4 218 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [0,0,0,0,0,1|3,0,0]=4 219 B11R1.21 O=C(O)C1=CC(=C(C=C1)S)Br Z1269190145 [0,0,0,0,0,1|2,1,0]=4 220 B11R1.21 O=C(O)C1=CC(=C(N=C1)Br)Br Z1269238021 [0,0,0,0,0,1|1,2,0]=4 221 B11R1.21 O=C(O)C1=CC(=C(N=C1)Br)Cl Z1269230032 [0,0,0,0,0,1|1,1,0]=3 222 B11R1.21 O=C(O)C1=CC(=C(N=C1)Br)O Z1269173146 [0,0,0,0,0,1|2,1,0]=4 223 B11R1.21 O=C(O)C1=CC(=C(N=C1)Cl)Br Z1269156435 [0,0,0,0,0,1|1,1,0]=3 224 B11R1.21 O=C(O)C1=CC(=C(N=C1)Cl)Cl Z104477552 [0,0,0,0,0,1|1,0,0]=2 225 B11R1.21 O=C(O)C1=CC(=C(N=C1)Cl)F Z1198320200 [0,0,0,0,0,1|1,1,0]=3 226 B11R1.21 O=C(O)C1=CC(=C(N=C1)F)Br Z1269243604 [0,0,0,0,0,1|1,2,0]=4 227 B11R1.21 O=C(O)C1=CC(=C(N=C1)F)Cl Z1198162771 [0,0,0,0,0,1|1,1,0]=3 228 B11R1.21 O=C(O)C1=CC(=C(N=C1)F)F Z1198183193 [0,0,0,0,0,1|1,2,0]=4 229 B11R1.21 O=C(O)C1=CC(=C(N=C1)I)O Z1269115116 [0,0,0,0,0,1|2,1,0]=4 230 B11R1.21 O=C(O)C1=CC(=C(N=C1)O)F Z1255436475 [0,0,0,0,0,1|2,1,0]=4 231 B11R1.21 O=C(O)C1=CC=C(C(=O)O1)O Z1262515745 [0,0,0,0,0,1|2,0,0]=3 232 B11R1.21 O=C(O)C1=CNC(=O)C(=C1)Br Z1259335940 [0,0,0,0,0,1|2,1,0]=4 233 B11R1.21 O=C(O)C1=CNC(=O)C(=C1)Cl Z752370728 [0,0,0,0,0,1|2,0,0]=3 234 B11R1.21 O=C(O)C1=NC(=C(C=C1)Br)Cl Z1269141215 [0,0,0,0,0,1|1,1,0]=3 235 B11R1.21 O=C(O)C1=NC(=C(C=C1)Br)F Z1269234071 [0,0,0,0,0,1|1,2,0]=4 236 B11R1.21 O=C(O)C1=NC(=C(C=C1)Br)O Z1269135378 [0,0,0,0,0,1|2,1,0]=4 237 B11R1.21 O=C(O)C1=NC(=C(C=C1)Cl)F Z1198183192 [0,0,0,0,0,1|1,1,0]=3 238 B11R1.21 O=C(O)C1=NC(=C(C=C1)F)Br Z1269231554 [0,0,0,0,0,1|1,2,0]=4 239 B11R1.21 O=C(O)C1=NC(=C(C=C1)F)Cl Z1250208606 [0,0,0,0,0,1|1,1,0]=3 240 B11R1.21 O=C(O)C1=NC=C(C(=C1)O)Br Z1269108466 [0,0,0,0,0,1|2,1,0]=4 241 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)Cl Z57127891 [0,0,0,0,0,1|2,0,1]=4 242 B11R1.21 OB(O)C1=CC(=C(C=C1)Cl)Cl Z336080010 [0,0,0,0,0,1|2,0,1]=4 243 B11R1.74 CC(=O)C1=CC(=CC(=C1)Cl)Cl Z1201618067 [0,0,0,0,0,1|2,0,0]=3 244 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)Cl Z1201622911 [0,0,0,0,0,1|2,1,0]=4 245 B11R1.74 CC(=O)C1=NC(=CC(=C1)Br)Cl Z1269118257 [0,0,0,0,0,1|2,1,0]=4 246 B11R1.74 CC1=CC(=CC(=C1)Br)C(=O)O Z1205656813 [0,0,0,0,0,1|2,1,0]=4 247 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)C Z104476972 [0,0,0,0,0,1|3,0,0]=4 248 B11R1.74 CC1=CC(=CC(=C1)Cl)C(=O)O Z1198280234 [0,0,0,0,0,1|2,0,0]=3 249 B11R1.74 CC1=CC(=CC(=C1)F)C(=O)O Z1201622041 [0,0,0,0,0,1|2,1,0]=4 250 B11R1.74 CC1=CC(=CC(=C1)N)C(=O)O Z1079174668 [0,0,0,0,0,1|3,0,0]=4 251 B11R1.74 CC1=CC(=CC(=C1)O)C(=O)O Z1198232670 [0,0,0,0,0,1|3,0,0]=4 252 B11R1.74 CC1=CC(=CC(=N1)C)C(=O)O Z3234892100 [0,0,0,0,0,1|3,0,0]=4 253 B11R1.74 CC1=CC(=CC(=O)N1)C(=O)O Z1198178343 [0,0,0,0,0,1|3,0,0]=4 254 B11R1.74 CC1=CC(=NC(=C1)Br)C(=O)O Z1269120539 [0,0,0,0,0,1|2,1,0]=4 255 B11R1.74 CC1=CC(=NC(=C1)C)C(=O)O Z2004548076 [0,0,0,0,0,1|3,0,0]=4 256 B11R1.74 CC1=CC(=NC(=C1)Cl)C(=O)O Z1198233196 [0,0,0,0,0,1|2,0,0]=3 257 B11R1.74 CC1=CC(=O)NC(=C1)C(=O)O Z2213893336 [0,0,0,0,0,1|3,0,0]=4 258 B11R1.74 CC1=NC(=CC(=C1)C(=O)Cl)Cl Z1203161819 [0,0,0,0,0,1|3,0,0]=4 259 B11R1.74 CC1=NC(=CC(=C1)C(=O)N)Cl Z1262627147 [0,0,0,0,0,1|3,0,0]=4 260 B11R1.74 CC1=NC(=CC(=C1)C(=O)O)Br Z1269142163 [0,0,0,0,0,1|2,1,0]=4 261 B11R1.74 CC1=NC(=CC(=C1)C(=O)O)Cl Z1203161820 [0,0,0,0,0,1|2,0,0]=3 262 B11R1.74 CC1=NC(=CC(=C1)Cl)C(=O)[O-] Z5864802442 [0,0,0,0,0,1|2,0,1]=4 263 B11R1.74 CC1=NC(=CC(=N1)Cl)C(=O)O Z1255426069 [0,0,0,0,0,1|2,0,0]=3 264 B11R1.74 CC1=NC(=CC(=O)N1)C(=O)O Z2830621415 [0,0,0,0,0,1|3,0,0]=4 265 B11R1.74 CC1=NC(=NC(=C1)C(=O)O)C Z965072050 [0,0,0,0,0,1|3,0,0]=4 266 B11R1.74 CC1=NC(=NC(=C1)C(=O)O)Cl Z1198155296 [0,0,0,0,0,1|2,0,0]=3 267 B11R1.74 CC1=NC(=O)NC(=C1)C(=O)O Z426199850 [0,0,0,0,0,1|3,0,0]=4 268 B11R1.74 NC(=O)C1=CC(=CC(=C1)N)Cl Z1255460929 [0,0,0,0,0,1|3,0,0]=4 269 B11R1.74 NC(=O)C1=NC(=NC(=C1)Cl)Cl Z1198236153 [0,0,0,0,0,1|2,0,0]=3 270 B11R1.74 NC1=CC(=CC(=C1)Br)C(=O)O Z57470132 [0,0,0,0,0,1|2,1,0]=4 271 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)N Z104475660 [0,0,0,0,0,1|3,0,0]=4 272 B11R1.74 NC1=CC(=CC(=C1)Cl)C(=O)O Z1079174624 [0,0,0,0,0,1|2,0,0]=3 273 B11R1.74 NC1=CC(=CC(=C1)I)C(=O)O Z1079174574 [0,0,0,0,0,1|2,1,0]=4 274 B11R1.74 NC1=CC(=CC(=C1)O)C(=O)O Z1198170625 [0,0,0,0,0,1|3,0,0]=4 275 B11R1.74 NC1=NC(=CC(=C1)C(=O)O)Cl Z385470930 [0,0,0,0,0,1|2,0,0]=3 276 B11R1.74 NC1=NC(=NC(=C1)C(=O)O)N Z1255441046 [0,0,0,0,0,1|3,0,0]=4 277 B11R1.74 O=C(Cl)C1=NC(=NC(=C1)Cl)Cl Z185586678 [0,0,0,0,0,1|2,0,0]=3 278 B11R1.74 O=C(O)C1=CC(=CC(=C1)Br)I Z1269214487 [0,0,0,0,0,1|1,2,0]=4 279 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)Br Z1269235666 [0,0,0,0,0,1|1,1,0]=3 280 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)Cl Z104476064 [0,0,0,0,0,1|1,0,0]=2 281 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)I Z1269204711 [0,0,0,0,0,1|1,1,0]=3 282 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)Br Z406678876 [0,0,0,0,0,1|1,2,0]=4 283 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)Cl Z1203161797 [0,0,0,0,0,1|1,1,0]=3 284 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)F Z104485974 [0,0,0,0,0,1|1,2,0]=4 285 B11R1.74 O=C(O)C1=CC(=CC(=C1)I)I Z277540160 [0,0,0,0,0,1|1,2,0]=4 286 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)Cl Z1198164258 [0,0,0,0,0,1|2,0,0]=3 287 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)O Z1255485190 [0,0,0,0,0,1|3,0,0]=4 288 B11R1.74 O=C(O)C1=CC(=NC(=C1)Br)Br Z1269137593 [0,0,0,0,0,1|1,2,0]=4 289 B11R1.74 O=C(O)C1=CC(=NC(=C1)Cl)Br Z1269205490 [0,0,0,0,0,1|1,1,0]=3 290 B11R1.74 O=C(O)C1=CC(=NC(=C1)Cl)Cl Z56899064 [0,0,0,0,0,1|1,0,0]=2 291 B11R1.74 O=C(O)C1=NC(=CC(=C1)Br)Cl Z1269179326 [0,0,0,0,0,1|1,1,0]=3 292 B11R1.74 O=C(O)C1=NC(=CC(=C1)Cl)Cl Z1198261855 [0,0,0,0,0,1|1,0,0]=2 293 B11R1.74 O=C(O)C1=NC(=CC(=N1)Cl)Cl Z1147171436 [0,0,0,0,0,1|2,0,0]=3 294 B11R1.74 O=C(O)C1=NC(=NC(=C1)Cl)Cl Z56887777 [0,0,0,0,0,1|1,0,0]=2 295 B11R1.74 O=C1C=C(C=C(N1)Br)C(=O)O Z2216720826 [0,0,0,0,0,1|2,1,0]=4 296 B11R1.74 O=C1C=C(C=C(N1)C(=O)O)O Z2028214371 [0,0,0,0,0,1|3,0,0]=4 297 B11R1.74 O=C1C=C(C=C(N1)O)C(=O)O Z56855768 [0,0,0,0,0,1|3,0,0]=4 298 B11R1.74 O=C1C=C(C=C(O1)C(=O)O)O Z1262546364 [0,0,0,0,0,1|2,0,0]=3 299 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O Z2848108703 [0,0,0,0,0,1|3,0,0]=4 300 B11R1.74 OB(O)C1=CC(=CC(=C1)Cl)Cl Z401461948 [0,0,0,0,0,1|2,0,1]=4 301 B8R1.1 CC1=CC=C(N1)C=O Z1198176668 [2,0,0,0,0,0|2,0,0]=4 302 B8R1.1 CC1=CC=C(O1)C=O Z56899216 [2,0,0,0,0,0|1,0,0]=3 303 B8R1.1 CC1=CC=C(O1)CO Z335244864 [2,0,0,0,0,0|1,0,1]=4 304 B8R1.1 CC1=CC=C(S1)C=O Z104478048 [2,0,0,0,0,0|1,1,0]=4 305 B8R1.1 CC1=CN=C(O1)C=O Z1198163538 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.1 CC1=COC(=C1)C=O Z1255374618 [2,0,0,0,0,0|1,0,0]=3 307 B8R1.1 CC1=COC(=N1)C=O Z1198279988 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.1 CC1=CSC(=C1)C=O Z1255423820 [2,0,0,0,0,0|1,1,0]=4 309 B8R1.1 CC1=NC=C(O1)C=O Z1198169811 [2,0,0,0,0,0|2,0,0]=4 310 B8R1.1 CC1=NOC(=C1)C=O Z1079442828 [2,0,0,0,0,0|2,0,0]=4 311 B8R1.1 O=CC1=CC(=CN1)I Z1183442838 [2,0,0,0,0,0|1,1,0]=4 312 B8R1.1 O=CC1=CC(=CO1)Br Z898215000 [2,0,0,0,0,0|0,1,0]=3 313 B8R1.1 O=CC1=CC(=CS1)Br Z104487482 [2,0,0,0,0,0|0,2,0]=4 314 B8R1.1 O=CC1=CC(=CS1)Cl Z1198313989 [2,0,0,0,0,0|0,1,0]=3 315 B8R1.1 O=CC1=CC(=CS1)I Z1269222755 [2,0,0,0,0,0|0,2,0]=4 316 B8R1.1 O=CC1=CC=C(O1)Br Z57041993 [2,0,0,0,0,0|0,1,0]=3 317 B8R1.1 O=CC1=CC=C(O1)Cl Z57834244 [2,0,0,0,0,0|0,0,0]=2 318 B8R1.1 O=CC1=CC=C(O1)I Z57313911 [2,0,0,0,0,0|0,1,0]=3 319 B8R1.1 O=CC1=CC=C(S1)Br Z55928862 [2,0,0,0,0,0|0,2,0]=4 320 B8R1.1 O=CC1=CC=C(S1)Cl Z220630970 [2,0,0,0,0,0|0,1,0]=3 321 B8R1.1 O=CC1=CC=C(S1)F Z1198317148 [2,0,0,0,0,0|0,2,0]=4 322 B8R1.1 O=CC1=CC=C(S1)I Z1269210626 [2,0,0,0,0,0|0,2,0]=4 323 B8R1.1 O=CC1=CN=C(S1)Cl Z1201621106 [2,0,0,0,0,0|1,1,0]=4 324 B8R1.1 O=CC1=CSC(=C1)Cl Z1255367581 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.1 O=CC1=CSC(=N1)Cl Z1201625112 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.1 O=CC1=NC(=CS1)Cl Z1216838518 [2,0,0,0,0,0|1,1,0]=4 327 B8R1.1 O=CC1=NC=C(S1)Cl Z1201624665 [2,0,0,0,0,0|1,1,0]=4 328 B8R1.1 OCC1=CC=C(S1)Cl Z381678198 [2,0,0,0,0,0|0,1,1]=4 329 B8R1.7 CC(=O)C1=CC=CN1 Z56899162 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.7 CC(=O)C1=CC=CS1 Z57127896 [2,0,0,0,0,0|1,1,0]=4 331 B8R1.7 CC(=O)C1=CN=CO1 Z1255430875 [2,0,0,0,0,0|2,0,0]=4 332 B8R1.7 CC(=O)C1=NC=CO1 Z1198173545 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.7 N=C(N)C1=CC=CO1 Z823287458 [2,0,0,0,0,0|2,0,0]=4 334 B8R1.7 NC(=O)C1=CC=CN1 Z135897752 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.7 NC(=O)C1=CC=CO1 Z33546471 [2,0,0,0,0,0|1,0,0]=3 336 B8R1.7 NC(=O)C1=CC=CS1 Z33546758 [2,0,0,0,0,0|1,1,0]=4 337 B8R1.7 NC(=O)C1=CN=CO1 Z1198164353 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.7 NC(=S)C1=CC=CO1 Z235345623 [2,0,0,0,0,0|1,1,0]=4 339 B8R1.7 O=C(Cl)C1=CC=CS1 Z168827498 [2,0,0,0,0,0|1,1,0]=4 340 B8R1.7 O=C(O)C1=CC=CN1 Z94599900 [2,0,0,0,0,0|1,0,0]=3 341 B8R1.7 O=C(O)C1=CC=CO1 Z104473462 [2,0,0,0,0,0|0,0,0]=2 342 B8R1.7 O=C(O)C1=CC=NO1 Z56943419 [2,0,0,0,0,0|1,0,0]=3 343 B8R1.7 O=C(O)C1=CC=NS1 Z1079264356 [2,0,0,0,0,0|1,1,0]=4 344 B8R1.7 O=C(O)C1=CN=CN1 Z993967082 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.7 O=C(O)C1=CN=CO1 Z204020264 [2,0,0,0,0,0|1,0,0]=3 346 B8R1.7 O=C(O)C1=CN=CS1 Z204146918 [2,0,0,0,0,0|1,1,0]=4 347 B8R1.7 O=C(O)C1=CNC=C1 Z1154253207 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.7 O=C(O)C1=COC=C1 Z164706016 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.7 O=C(O)C1=COC=N1 Z1095349994 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.7 O=C(O)C1=CSC=C1 Z147647094 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.7 O=C(O)C1=CSC=N1 Z800222638 [2,0,0,0,0,0|2,0,0]=4 352 B8R1.7 O=C(O)C1=NNC=C1 Z381357668 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.7 O=C(O)C1=NOC=C1 Z147642256 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.7 O=C(O)C1=NSC=C1 Z1198233153 [2,0,0,0,0,0|2,0,0]=4 355 B8R1.7 O=C([O-])C1=NC=CO1 Z2689946948 [2,0,0,0,0,0|1,0,1]=4 356 B10R1.14 CC1=CC=C(O1)/C(=N/O)/C Z49568559 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.14 CC1=CC=C(O1)C(=O)CCl Z1205658134 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.14 CCC(=O)C1=CC=C(S1)Cl Z275168444 [1,1,0,0,0,0|1,1,0]=4 359 B10R1.14 CNC(=O)C1=CC=C(O1)Br Z32016557 [1,1,0,0,0,0|1,1,0]=4 360 B10R1.14 CNC(=O)C1=CC=C(S1)Cl Z32016484 [1,1,0,0,0,0|1,1,0]=4 361 B10R1.14 COC(=O)C1=CC(=CN1)Br Z99028679 [1,1,0,0,0,0|1,1,0]=4 362 B10R1.14 COC(=O)C1=CC(=CN1)Cl Z209672926 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.14 COC(=O)C1=CC(=CN1)N Z802671458 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.14 COC(=O)C1=CC(=CO1)Br Z1269235333 [1,1,0,0,0,0|0,1,0]=3 365 B10R1.14 COC(=O)C1=CC(=CS1)N Z1198172172 [1,1,0,0,0,0|1,1,0]=4 366 B10R1.14 COC(=O)C1=CC=C(N1)Br Z1269211284 [1,1,0,0,0,0|1,1,0]=4 367 B10R1.14 COC(=O)C1=CC=C(N1)C Z1255384708 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.14 COC(=O)C1=CC=C(O1)Br Z18368947 [1,1,0,0,0,0|0,1,0]=3 369 B10R1.14 COC(=O)C1=CC=C(S1)N Z271004852 [1,1,0,0,0,0|1,1,0]=4 370 B10R1.14 N/C(=N\O)/C1=CC=C(O1)Br Z381355942 [1,1,0,0,0,0|1,1,0]=4 371 B10R1.14 NNC(=O)C1=CC(=CN1)Cl Z104341130 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.14 O=C(CCl)C1=CC=C(O1)Cl Z1262497365 [1,1,0,0,0,0|1,0,0]=3 373 B10R1.14 O=C(CCl)C1=CC=C(S1)Cl Z359503360 [1,1,0,0,0,0|1,1,0]=4 374 B10R1.14 O=C(NO)C1=CC=C(O1)Br Z59182054 [1,1,0,0,0,0|0,1,0]=3 375 B10R1.14 O=C(NO)C1=CC=C(S1)Br Z59182851 [1,1,0,0,0,0|0,2,0]=4 376 B10R1.31 CCC1=CC=C(N1)C(=O)O Z1416166268 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.31 CCC1=CC=C(O1)C(=O)O Z57564911 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.31 CCC1=CNC(=C1)C(=O)O Z3243445142 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.31 CCC1=NC=C(O1)C(=O)O Z1205496428 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.31 CCC1=NOC(=C1)C(=O)O Z1198173455 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.31 CNC1=NC=C(O1)C(=O)O Z2732452967 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.31 COC1=CC=C(S1)C(=O)O Z1198160366 [1,1,0,0,0,0|1,1,0]=4 383 B10R1.31 COC1=CSC(=C1)C(=O)O Z335442452 [1,1,0,0,0,0|1,1,0]=4 384 B10R1.31 CSC1=CC=C(O1)C(=O)O Z963425062 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.31 CSC1=CC=C(S1)C(=O)O Z1201619509 [1,1,0,0,0,0|1,1,0]=4 386 B10R1.31 N#CC1=CC=C(N1)C(=O)O Z1205656493 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.31 N#CC1=CC=C(O1)C(=O)O Z1203162525 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.31 N#CC1=CC=C(S1)C(=O)O Z1198343175 [1,1,0,0,0,0|1,1,0]=4 389 B10R1.31 N#CC1=CNC(=C1)C(=O)O Z1198267221 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.31 N#CC1=CSC(=C1)C(=O)O Z1255419942 [1,1,0,0,0,0|1,1,0]=4 391 B10R1.31 NCC1=CC=C(O1)C(=O)N Z1324054900 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.31 NCC1=CC=C(O1)C(=O)O Z1272117771 [1,1,0,0,0,0|1,0,0]=3 393 B10R1.31 NCC1=CSC(=C1)C(=O)O Z3487862165 [1,1,0,0,0,0|1,1,0]=4 394 B10R1.31 O=C(O)C1=CC=C(O1)CO Z385458092 [1,1,0,0,0,0|1,0,0]=3 395 B10R1.31 O=C(O)C1=CC=C(S1)CO Z1134175383 [1,1,0,0,0,0|1,1,0]=4 396 B10R1.31 O=CC1=CC=C(N1)C(=O)O Z1198223703 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.31 O=CC1=CC=C(O1)C(=O)O Z1201617369 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.31 O=CC1=CC=C(S1)C(=O)O Z1201619678 [1,1,0,0,0,0|1,1,0]=4 399 B10R1.31 O=CC1=CNC(=C1)C(=O)O Z1190318813 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.31 O=CC1=CSC(=C1)C(=O)O Z1262525684 [1,1,0,0,0,0|1,1,0]=4 401 B10R1.59 CC1=C(N=C(S1)Cl)C(=O)O Z1255493333 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.59 CC1=C(OC(=C1)Br)C(=O)O Z360059658 [1,1,0,0,0,0|0,1,0]=3 403 B10R1.59 CC1=C(SC(=C1)F)C(=O)O Z3055840367 [1,1,0,0,0,0|0,2,0]=4 404 B10R1.59 CC1=C(SC(=N1)Cl)C(=O)O Z1198163499 [1,1,0,0,0,0|1,1,0]=4 405 B10R1.59 CC1=CC(=C(O1)C(=O)O)C Z1198180768 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.59 CC1=CC(=C(S1)C(=O)O)Br Z1259057378 [1,1,0,0,0,0|1,1,0]=4 407 B10R1.59 CC1=CC(=C(S1)C(=O)O)C Z1198163824 [1,1,0,0,0,0|1,1,0]=4 408 B10R1.59 CC1=CC(=C(S1)C(=O)O)Cl Z1198181376 [1,1,0,0,0,0|1,1,0]=4 409 B10R1.59 CC1=NC(=C(O1)C(=O)O)C Z335442470 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.59 CN1C=C(C=C1C(=O)O)Br Z164677890 [1,1,0,0,0,0|1,1,0]=4 411 B10R1.59 CN1C=C(C=C1C(=O)O)Cl Z166651272 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.59 CN1C=C(C=C1C(=O)O)N Z3244827169 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.59 O=C(O)C1=C(C=C(S1)Br)Br Z1269205205 [1,1,0,0,0,0|0,2,0]=4 414 B10R1.59 O=C(O)C1=C(C=C(S1)Br)Cl Z1486037274 [1,1,0,0,0,0|0,2,0]=4 415 B10R1.59 O=C(O)C1=C(C=C(S1)Cl)I Z4905375164 [1,1,0,0,0,0|0,1,0]=3 416 B10R1.59 O=C(O)C1=C(C=C(S1)F)Br Z4544304200 [1,1,0,0,0,0|0,2,0]=4 417 B10R1.59 O=C(O)C1=C(C=C(S1)F)Cl Z4284732443 [1,1,0,0,0,0|0,2,0]=4 418 B10R1.59 O=C(O)C1=C(N=C(S1)Cl)Cl Z425813688 [1,1,0,0,0,0|1,1,0]=4 419 B10R1.59 O=C(O)C1=C(SC(=C1)Cl)Cl Z89283593 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.194 CC(=O)C1=C(C(=CS1)Cl)Cl Z1198181375 [1,1,0,0,0,0|1,1,0]=4 421 B10R1.194 CC1=CC=C(N1C)C(=O)O Z154210042 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.194 CC1=COC(=C1C)C(=O)O Z1205496460 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.194 CC1=CSC(=C1Br)C(=O)O Z1753047778 [1,1,0,0,0,0|1,1,0]=4 424 B10R1.194 CC1=CSC(=C1C)C(=O)O Z1255497776 [1,1,0,0,0,0|1,1,0]=4 425 B10R1.194 CC1=CSC(=C1Cl)C(=O)O Z1198157106 [1,1,0,0,0,0|1,1,0]=4 426 B10R1.194 CC1=CSC(=C1I)C(=O)O Z1809367610 [1,1,0,0,0,0|1,1,0]=4 427 B10R1.194 CC1=NOC(=C1C)C(=O)O Z1198221230 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.194 O=C(O)C1=C(C(=CS1)Br)Cl Z4317190006 [1,1,0,0,0,0|0,2,0]=4 429 B12R1.48 CCC1=C(C=C(C=C1)C(=O)O)Cl Z1255376027 [0,1,0,0,0,1|2,0,0]=4 430 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)Cl Z57790676 [0,1,0,0,0,1|2,0,0]=4 431 B12R1.48 COC1=C(N=C(C=C1)C(=O)O)Cl Z1198174178 [0,1,0,0,0,1|2,0,0]=4 432 B12R1.48 COC1=COC(=CC1=O)C(=O)O Z1198280173 [0,1,0,0,0,1|2,0,0]=4 433 B12R1.48 N#CC1=C(C=C(C=C1)C(=O)O)Cl Z1255430722 [0,1,0,0,0,1|2,0,0]=4 434 B12R1.48 N#CC1=C(N=C(C=C1)C(=O)O)Cl Z1255434383 [0,1,0,0,0,1|2,0,0]=4 435 B12R1.48 O=C(O)C1=CC(=C(C=C1)CO)Cl Z1551918094 [0,1,0,0,0,1|2,0,0]=4 436 B12R1.48 O=CC1=C(C=C(C=C1)C(=O)O)Cl Z1262534327 [0,1,0,0,0,1|2,0,0]=4 437 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)Cl Z1198314407 [0,1,0,0,0,1|2,0,0]=4 438 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)Cl Z1741972864 [0,1,0,0,0,1|2,0,0]=4 439 B12R1.56 N#CC1=C(C=CC(=C1)C(=O)O)Cl Z1255446950 [0,1,0,0,0,1|2,0,0]=4 440 B12R1.56 N#CC1=C(C=CC(=N1)C(=O)O)Cl Z1255449319 [0,1,0,0,0,1|2,0,0]=4 441 B12R1.56 NNC1=C(C=CC(=C1)C(=O)O)Cl Z56951160 [0,1,0,0,0,1|2,0,0]=4 442 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)Cl Z1649775095 [0,1,0,0,0,1|2,0,0]=4 443 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)Cl)O Z1269151638 [0,1,0,0,0,1|2,0,0]=4 444 B12R1.232 CC1=C(C=C(C(=C1)Br)C(=O)O)Cl Z1993723520 [0,1,0,0,0,1|2,0,0]=4 445 B12R1.232 CC1=C(C=C(C(=C1)Br)Cl)C(=O)O Z1269169301 [0,1,0,0,0,1|1,1,0]=4 446 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)Cl)Cl Z1258905398 [0,1,0,0,0,1|2,0,0]=4 447 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)F)Cl Z1262560000 [0,1,0,0,0,1|2,0,0]=4 448 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)I)Cl Z1681355647 [0,1,0,0,0,1|2,0,0]=4 449 B12R1.232 CC1=C(C=C(C(=C1)Cl)Cl)C(=O)O Z1509028747 [0,1,0,0,0,1|1,0,0]=3 450 B12R1.232 CC1=C(C=C(C(=C1)F)Cl)C(=O)O Z1650054506 [0,1,0,0,0,1|1,1,0]=4 451 B12R1.232 CC1=C(C=C(C(=N1)Cl)Cl)C(=O)O Z1504683317 [0,1,0,0,0,1|1,0,0]=3 452 B12R1.232 CC1=C(N=C(C(=C1)Br)C(=O)O)Cl Z1665251828 [0,1,0,0,0,1|2,0,0]=4 453 B12R1.232 CC1=C(N=C(C(=C1)C(=O)O)Cl)Cl Z3464419694 [0,1,0,0,0,1|2,0,0]=4 454 B12R1.232 CC1=C(N=C(C(=C1)F)C(=O)O)Cl Z4920184728 [0,1,0,0,0,1|2,0,0]=4 455 B12R1.232 CC1=CC(=C(C=C1C(=O)O)C)Cl Z1201625877 [0,1,0,0,0,1|2,0,0]=4 456 B12R1.232 NC1=C(C=C(C(=C1)C(=O)O)Br)Cl Z1269171992 [0,1,0,0,0,1|2,0,0]=4 457 B12R1.232 NC1=C(C=C(C(=C1)Cl)Cl)C(=O)O Z1269194034 [0,1,0,0,0,1|1,0,0]=3 458 B12R1.232 NC1=C(C=C(C(=C1)Cl)I)C(=O)O Z1681336195 [0,1,0,0,0,1|1,1,0]=4 459 B12R1.232 NC1=C(C=C(C(=C1)F)C(=O)O)Cl Z1262559064 [0,1,0,0,0,1|2,0,0]=4 460 B12R1.232 NC1=C(C=C(C(=C1)F)Cl)C(=O)O Z1198234893 [0,1,0,0,0,1|1,1,0]=4 461 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)Br)F Z1269228274 [0,1,0,0,0,1|1,1,0]=4 462 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)Br Z1450943879 [0,1,0,0,0,1|1,1,0]=4 463 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)Cl Z1450943901 [0,1,0,0,0,1|1,1,0]=4 464 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)I Z1450943854 [0,1,0,0,0,1|1,1,0]=4 465 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)O Z1262517120 [0,1,0,0,0,1|1,1,0]=4 466 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)I)F Z3325789422 [0,1,0,0,0,1|1,1,0]=4 467 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Cl)Cl Z104509126 [0,1,0,0,0,1|1,1,0]=4 468 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Cl)F Z1203161787 [0,1,0,0,0,1|1,1,0]=4 469 B12R1.232 O=C(O)C1=C(C=C(C(=C1)I)Cl)Cl Z1450923128 [0,1,0,0,0,1|1,1,0]=4 470 B12R1.232 O=C(O)C1=C(N=C(C(=C1)F)Cl)Cl Z1065630354 [0,1,0,0,0,1|1,1,0]=4 471 B12R1.367 CCC(=O)C1=CC(=C(C=C1)Cl)Cl Z56858267 [0,1,0,0,0,1|2,0,0]=4 472 B12R1.367 CNC(=O)C1=CC(=C(C=C1)Cl)Cl Z32016404 [0,1,0,0,0,1|2,0,0]=4 473 B12R1.367 COC(=O)C1=CC(=C(C=C1)Cl)Cl Z19801006 [0,1,0,0,0,1|1,0,0]=3 474 B12R1.367 COC(=O)C1=CC(=C(C=C1)Cl)N Z53836840 [0,1,0,0,0,1|2,0,0]=4 475 B12R1.367 COC(=O)C1=CC(=C(C=C1)N)Cl Z1243607759 [0,1,0,0,0,1|2,0,0]=4 476 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)Cl Z25120254 [0,1,0,0,0,1|2,0,0]=4 477 B12R1.367 COC(=O)C1=CC(=C(N=C1)Cl)Br Z1269219819 [0,1,0,0,0,1|1,1,0]=4 478 B12R1.367 COC(=O)C1=CC(=C(N=C1)Cl)Cl Z18518515 [0,1,0,0,0,1|1,0,0]=3 479 B12R1.367 COC(=O)C1=CC(=C(N=C1)F)Cl Z1201626560 [0,1,0,0,0,1|1,1,0]=4 480 B12R1.367 COC(=O)C1=CC(=C(N=C1)N)Cl Z955107360 [0,1,0,0,0,1|2,0,0]=4 481 B12R1.367 COC(=O)C1=COC(=O)C(=C1)Br Z1269138230 [0,1,0,0,0,1|1,1,0]=4 482 B12R1.367 COC(=O)C1=NC(=C(N=C1)Br)Cl Z1813200188 [0,1,0,0,0,1|1,1,0]=4 483 B12R1.367 COC(=O)C1=NC(=C(N=C1)Cl)Br Z2733507230 [0,1,0,0,0,1|1,1,0]=4 484 B12R1.367 COC(=O)C1=NC(=C(N=C1)Cl)C Z1198649623 [0,1,0,0,0,1|2,0,0]=4 485 B12R1.367 COC(=O)C1=NN=C(C(=C1)C)Cl Z5011039719 [0,1,0,0,0,1|2,0,0]=4 486 B12R1.367 NCC(=O)C1=CC(=C(C=C1)Cl)Cl Z1269180328 [0,1,0,0,0,1|2,0,0]=4 487 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)Cl)Cl Z56896209 [0,1,0,0,0,1|2,0,0]=4 488 B12R1.367 O=C(CO)C1=CC(=C(C=C1)Cl)Cl Z228585652 [0,1,0,0,0,1|1,0,0]=3 489 B12R1.893 CC(=O)C1=C(C(=C(C=C1)Cl)Cl)Cl Z104480064 [0,1,0,0,0,1|2,0,0]=4 490 B12R1.893 CC(=O)C1=C(C(=C(C=C1)Cl)Cl)O Z1021471392 [0,1,0,0,0,1|2,0,0]=4 491 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)Cl)Cl Z1509047169 [0,1,0,0,0,1|2,0,0]=4 492 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)F)Cl Z1681354639 [0,1,0,0,0,1|2,0,0]=4 493 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)N)Cl Z1262523764 [0,1,0,0,0,1|2,0,0]=4 494 B12R1.893 CC1=C(C(=C(C=N1)C(=O)O)Br)Cl Z3601604527 [0,1,0,0,0,1|2,0,0]=4 495 B12R1.893 CC1=C(C(=C(C=N1)C(=O)O)Cl)Cl Z1436111265 [0,1,0,0,0,1|2,0,0]=4 496 B12R1.893 CC1=C(C(=C(C=N1)C(=O)O)O)Cl Z1262561407 [0,1,0,0,0,1|2,0,0]=4 497 B12R1.893 CC1=C(C=CC(=C1Cl)Br)C(=O)O Z1269218350 [0,1,0,0,0,1|1,1,0]=4 498 B12R1.893 CC1=C(C=CC(=C1Cl)Cl)C(=O)O Z1269122266 [0,1,0,0,0,1|1,0,0]=3 499 B12R1.893 CC1=C(C=CC(=C1N)C(=O)O)Cl Z104343432 [0,1,0,0,0,1|2,0,0]=4 500 B12R1.893 CC1=C(C=CC(=C1O)C(=O)O)Cl Z1504689054 [0,1,0,0,0,1|2,0,0]=4 501 B12R1.893 NC(=O)C1=C(C(=C(C=N1)Cl)Cl)Cl Z56797343 [0,1,0,0,0,1|2,0,0]=4 502 B12R1.893 NC1=C(C(=CC=C1Cl)C(=O)O)Cl Z1269241194 [0,1,0,0,0,1|2,0,0]=4 503 B12R1.893 NC1=C(C=CC(=C1Cl)Cl)C(=O)O Z362758768 [0,1,0,0,0,1|1,0,0]=3 504 B12R1.893 NC1=C(C=CC(=C1Cl)F)C(=O)O Z2079916376 [0,1,0,0,0,1|1,1,0]=4 505 B12R1.893 NC1=C(C=CC(=C1F)Cl)C(=O)O Z362758814 [0,1,0,0,0,1|1,1,0]=4 506 B12R1.893 NC1=C(C=CC(=C1O)Cl)C(=O)O Z1262513945 [0,1,0,0,0,1|2,0,0]=4 507 B12R1.893 O=C(O)C1=C(C(=C(C=C1)Br)Cl)F Z1269229072 [0,1,0,0,0,1|1,1,0]=4 508 B12R1.893 O=C(O)C1=C(C(=C(C=C1)Cl)Cl)Cl Z1269141366 [0,1,0,0,0,1|1,0,0]=3 509 B12R1.893 O=C(O)C1=C(C(=C(C=C1)Cl)Cl)O Z367679256 [0,1,0,0,0,1|1,0,0]=3 510 B12R1.893 O=C(O)C1=C(C(=C(C=C1)Cl)F)F Z1198172117 [0,1,0,0,0,1|1,1,0]=4 511 B12R1.893 O=C(O)C1=C(C(=C(C=C1)Cl)F)O Z1504674334 [0,1,0,0,0,1|1,1,0]=4 512 B12R1.893 O=C(O)C1=C(C(=C(C=C1)F)Cl)F Z1201621173 [0,1,0,0,0,1|1,1,0]=4 513 B12R1.893 O=C(O)C1=C(C(=C(C=N1)Cl)Cl)Cl Z56846825 [0,1,0,0,0,1|1,0,0]=3 514 B12R1.1005 CC1=C(C(=CC(=C1)C(=O)O)Cl)Br Z1551943705 [0,1,0,0,0,1|1,1,0]=4 515 B12R1.1005 CC1=C(C(=CC(=C1)C(=O)O)N)Cl Z3137491565 [0,1,0,0,0,1|2,0,0]=4 516 B12R1.1005 CC1=C(C(=NC(=C1)C(=O)O)Cl)Br Z5094273978 [0,1,0,0,0,1|1,1,0]=4 517 B12R1.1005 NC1=C(C(=CC(=C1)C(=O)O)O)Cl Z1262544602 [0,1,0,0,0,1|2,0,0]=4 518 B12R1.1005 NC1=C(C(=NC(=C1)C(=O)O)O)Cl Z1262528000 [0,1,0,0,0,1|2,0,0]=4 519 B12R1.1005 NC1=C(C=C(C=C1Cl)C(=O)O)Cl Z1269189983 [0,1,0,0,0,1|2,0,0]=4 520 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Cl)Br)Cl Z1269216347 [0,1,0,0,0,1|1,1,0]=4 521 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)Br)Cl Z1269185562 [0,1,0,0,0,1|1,1,0]=4 522 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)Cl Z1262519254 [0,1,0,0,0,1|2,0,0]=4 523 B12R1.11 CCC1=NC(=CC(=C1)C(=O)O)Cl Z1255421058 [0,1,0,0,0,1|2,0,0]=4 524 B12R1.11 CNC1=NC(=CC(=C1)C(=O)O)Cl Z385470286 [0,1,0,0,0,1|2,0,0]=4 525 B12R1.11 COC1=CC(=CC(=C1)Cl)C(=O)O Z1255488484 [0,1,0,0,0,1|2,0,0]=4 526 B12R1.11 CSC1=CC(=CC(=C1)Cl)C(=O)O Z1508925199 [0,1,0,0,0,1|2,0,0]=4 527 B12R1.11 CSC1=NC(=CC(=C1)C(=O)O)Cl Z732206900 [0,1,0,0,0,1|2,0,0]=4 528 B12R1.11 CSC1=NC(=CC(=N1)Cl)C(=O)O Z1269190140 [0,1,0,0,0,1|2,0,0]=4 529 B12R1.11 CSC1=NC(=NC(=C1)C(=O)O)Cl Z3242892736 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)Cl Z1262556297 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.358 CNC(=O)C1=CC(=CC(=C1)Cl)Cl Z32016569 [0,1,0,0,0,1|2,0,0]=4 532 B12R1.358 CNC(=O)C1=CC(=NC(=C1)Cl)Cl Z246898212 [0,1,0,0,0,1|2,0,0]=4 533 B12R1.358 CNC(=O)C1=NC(=CC(=C1)Cl)Cl Z1269235086 [0,1,0,0,0,1|2,0,0]=4 534 B12R1.358 COC(=O)C1=CC(=CC(=C1)Cl)Cl Z18403814 [0,1,0,0,0,1|1,0,0]=3 535 B12R1.358 COC(=O)C1=CC(=CC(=C1)N)Cl Z1079174384 [0,1,0,0,0,1|2,0,0]=4 536 B12R1.358 COC(=O)C1=CC(=NC(=C1)C)Cl Z1203162085 [0,1,0,0,0,1|2,0,0]=4 537 B12R1.358 COC(=O)C1=CC(=NC(=C1)Cl)Cl Z1160850376 [0,1,0,0,0,1|1,0,0]=3 538 B12R1.358 COC(=O)C1=NC(=CC(=C1)Br)Cl Z1269219564 [0,1,0,0,0,1|1,1,0]=4 539 B12R1.358 COC(=O)C1=NC(=CC(=C1)Cl)Cl Z1269143192 [0,1,0,0,0,1|1,0,0]=3 540 B12R1.358 COC(=O)C1=NC(=CC(=N1)Cl)Cl Z1269162379 [0,1,0,0,0,1|2,0,0]=4 541 B12R1.358 COC(=O)C1=NC(=NC(=C1)C)Cl Z1157726197 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.358 COC(=O)C1=NC(=NC(=C1)Cl)C Z1255437357 [0,1,0,0,0,1|2,0,0]=4 543 B12R1.358 COC(=O)C1=NC(=NC(=C1)Cl)Cl Z1157726181 [0,1,0,0,0,1|1,0,0]=3 544 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Cl)Cl)O Z56858262 [0,1,0,0,0,1|2,0,0]=4 545 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)C Z1262523452 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)N Z362758746 [0,1,0,0,0,1|2,0,0]=4 547 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)O Z367679262 [0,1,0,0,0,1|2,0,0]=4 548 B12R1.511 CC1=C(C(=NC(=C1)Cl)C(=O)O)Br Z4932920967 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.511 CC1=C(C=C(C=C1Cl)Br)C(=O)O Z1450944023 [0,1,0,0,0,1|1,1,0]=4 550 B12R1.511 CC1=C(C=C(N=C1Cl)Cl)C(=O)O Z1269241834 [0,1,0,0,0,1|1,0,0]=3 551 B12R1.511 CC1=C(N=C(C=C1Cl)Cl)C(=O)O Z3243124081 [0,1,0,0,0,1|1,0,0]=3 552 B12R1.511 CC1=CC(=C(C(=C1)Cl)Br)C(=O)O Z1450944061 [0,1,0,0,0,1|2,0,0]=4 553 B12R1.511 CC1=CC(=C(C(=C1)Cl)N)C(=O)O Z362758754 [0,1,0,0,0,1|2,0,0]=4 554 B12R1.511 NC1=C(C(=CC(=C1)Cl)C(=O)O)F Z1079174618 [0,1,0,0,0,1|2,0,0]=4 555 B12R1.511 NC1=C(C=C(C=C1Br)Cl)C(=O)O Z1222394694 [0,1,0,0,0,1|1,1,0]=4 556 B12R1.511 NC1=C(C=C(C=C1Cl)Br)C(=O)O Z362758802 [0,1,0,0,0,1|1,1,0]=4 557 B12R1.511 NC1=C(C=C(C=C1Cl)Cl)C(=O)O Z56788599 [0,1,0,0,0,1|1,0,0]=3 558 B12R1.511 NC1=C(C=C(C=C1Cl)F)C(=O)O Z362758766 [0,1,0,0,0,1|1,1,0]=4 559 B12R1.511 NC1=C(C=C(C=C1F)Cl)C(=O)O Z362758770 [0,1,0,0,0,1|1,1,0]=4 560 B12R1.511 NC1=CC(=C(C(=C1)Cl)Cl)C(=O)O Z1079174590 [0,1,0,0,0,1|2,0,0]=4 561 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)Cl)F Z1450923305 [0,1,0,0,0,1|1,1,0]=4 562 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)Cl)O Z367679264 [0,1,0,0,0,1|1,1,0]=4 563 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Br)F Z1416179586 [0,1,0,0,0,1|1,1,0]=4 564 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Br)O Z367679326 [0,1,0,0,0,1|1,1,0]=4 565 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)Br Z1269240944 [0,1,0,0,0,1|1,0,0]=3 566 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)Cl Z1269186387 [0,1,0,0,0,1|1,0,0]=3 567 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)F Z1450943906 [0,1,0,0,0,1|1,0,0]=3 568 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)I Z56893265 [0,1,0,0,0,1|1,0,0]=3 569 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)O Z111571460 [0,1,0,0,0,1|1,0,0]=3 570 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)F)Br Z1460683847 [0,1,0,0,0,1|1,1,0]=4 571 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Cl)Br Z3239240815 [0,1,0,0,0,1|1,1,0]=4 572 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Cl)O Z367679240 [0,1,0,0,0,1|1,1,0]=4 573 B12R1.511 O=C(O)C1=C(C(=CC(=C1)O)Cl)Cl Z2310950065 [0,1,0,0,0,1|2,0,0]=4 574 B12R1.511 O=C(O)C1=C(C(=NC(=C1)Cl)Cl)F Z1508998042 [0,1,0,0,0,1|1,0,0]=3 575 B12R1.63 COC(=O)C1=CC(=C(O1)C)C=O Z1511752016 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.63 COC(=O)C1=CC(=C(O1)C)CN Z2895330871 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.63 COC(=O)C1=CC(=C(S1)Cl)C=O Z2692554472 [0,2,0,0,0,0|1,1,0]=4 578 B12R1.63 COC(=O)C1=CC(=C(S1)Cl)CN Z3179194286 [0,2,0,0,0,0|1,1,0]=4 579 B12R1.68 CCC1=C(OC(=C1)C(=O)O)CC Z1262544041 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.111 CC(=O)C1=C(OC(=C1)C(=O)O)C Z1262529721 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.111 O=C(O)C1=CC(=C(N1)[N+](=O)[O-])Cl Z425797012 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.111 O=C(O)C1=CC(=C(O1)C(=O)O)Br Z1923114365 [0,2,0,0,0,0|1,1,0]=4 583 B12R1.362 COC(=O)C1=C(C(=C(S1)Cl)Cl)N Z4304772836 [0,2,0,0,0,0|0,1,0]=3 584 B12R1.362 COC(=O)C1=C(C(=C(S1)Cl)Cl)O Z1269173180 [0,2,0,0,0,0|0,1,0]=3 585 B12R1.766 COC1=C(SC(=C1Cl)Cl)C(=O)O Z1813196625 [0,2,0,0,0,0|0,1,0]=3 586 B10R1.13 O=C1C=CC(=CO1)C(=O)O Z104472302 [0,0,1,1,0,0|2,0,0]=4 587 B10R1.39 O=CC1=C(OC=C1)C(=O)O Z2681280636 [0,0,1,1,0,0|2,0,0]=4 588 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [0,0,1,1,0,0|2,0,0]=4 589 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl Z135302154 [0,0,1,1,0,0|2,0,0]=4 590 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [0,0,1,1,0,0|2,0,0]=4 591 B10R1.113 O=C(O)C1=NC(=NC=C1)Cl Z1201623752 [0,0,1,1,0,0|2,0,0]=4 592 B10R1.113 O=C(O)C1=NC=CC(=C1)Cl Z57990012 [0,0,1,1,0,0|2,0,0]=4 593 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [0,0,1,1,0,0|2,0,0]=4 594 B10R1.118 OC1=C(C=C(C(=C1)Cl)Cl)Cl Z104479252 [0,0,1,1,0,0|2,0,0]=4 595 B8R0.2 O=C/C(=C(\Cl)/C(=O)O)/Cl Z147641078 [0,0,1,0,1,0|2,0,0]=4 596 B8R1.31 O=C(O)C1=C(CC1)Cl Z3358630818 [1,0,0,0,1,0|0,0,2]=4 597 B10R1.8 CC1=CC(=CC(=C1)Cl)C=O Z1198331552 [1,0,0,0,0,1|2,0,0]=4 598 B10R1.8 O=CC1=CC(=CC(=C1)Cl)Br Z1269145301 [1,0,0,0,0,1|1,1,0]=4 599 B10R1.8 O=CC1=CC(=CC(=C1)Cl)Cl Z452409804 [1,0,0,0,0,1|1,0,0]=3 600 B10R1.8 O=CC1=CC(=CC(=C1)Cl)I Z1269227543 [1,0,0,0,0,1|1,1,0]=4 601 B10R1.8 O=CC1=CC(=CC(=C1)F)Cl Z1203161793 [1,0,0,0,0,1|1,1,0]=4 602 B10R1.8 O=CC1=CC(=CC(=C1)O)Cl Z1198176477 [1,0,0,0,0,1|2,0,0]=4 603 B10R1.8 OCC1=NC(=NC(=C1)Cl)Cl Z1896515428 [1,0,0,0,0,1|1,0,1]=4 604 B10R1.54 CC1=CC=C(O1)CC(=O)O Z978942572 [1,0,0,0,0,1|1,0,0]=3 605 B10R1.54 CC1=CC=C(S1)CC(=O)O Z362118824 [1,0,0,0,0,1|1,1,0]=4 606 B10R1.54 CC1=CSC(=C1)CC(=O)O Z1255506269 [1,0,0,0,0,1|1,1,0]=4 607 B10R1.54 CC1=NC=C(O1)CC(=O)O Z1416193674 [1,0,0,0,0,1|2,0,0]=4 608 B10R1.54 CC1=NOC(=C1)CC(=O)O Z1205493696 [1,0,0,0,0,1|2,0,0]=4 609 B10R1.54 O=C(O)CC1=CC=C(S1)Cl Z285575844 [1,0,0,0,0,1|0,1,0]=3 610 B10R1.54 O=C(O)CN1C=C(C=N1)Cl Z729827274 [1,0,0,0,0,1|2,0,0]=4 611 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)Cl Z28128347 [0,0,0,0,0,2|2,0,0]=4 612 B12R1.19 CC(=O)NC1=NC=C(C(=C1)Cl)Cl Z1297118487 [0,0,0,0,0,2|2,0,0]=4 613 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [0,0,0,0,0,2|2,0,0]=4 614 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl Z2677377810 [0,0,0,0,0,2|2,0,0]=4 615 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,0,0,0,0,2|2,0,0]=4 616 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [0,0,0,0,0,2|1,1,0]=4 617 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [0,0,0,0,0,2|1,1,0]=4 618 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [0,0,0,0,0,2|1,0,0]=3 619 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [0,0,0,0,0,2|1,1,0]=4 620 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,0,0,0,0,2|2,0,0]=4 621 B12R1.101 CC(=O)NC1=CC(=CC(=C1)Cl)Cl Z30181347 [0,0,0,0,0,2|2,0,0]=4 622 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Cl)Cl Z1269159102 [0,0,0,0,0,2|1,0,0]=3