0 B9R1.35 CC(=O)C1=CC(Br)=CS1 BBL104318 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CC=C(C)O1 BBL027428 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CN(C)N=C1 BBL028299 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 CC(=O)C1=NN(C)C=C1 BBL039361 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 CC1=CC(C(=O)Cl)=CS1 BBL014946 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.35 CC1=CC(C(=O)Cl)=NO1 BBL014478 [0,0,0,0,0,0|2,1,0]=3 6 B9R1.35 CC1=CC(C(=O)O)=NO1 BBL015822 [0,0,0,0,0,0|1,1,0]=2 7 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BBL014853 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CC1=CC=C(C(=O)O)S1 BBL037421 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.35 CC1=CC=C([N+](=O)[O-])O1 BBL023677 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.35 CC1=NC(C(=O)O)=CO1 BBL028443 [0,0,0,0,0,0|1,1,0]=2 11 B9R1.35 CC1=NC(C(=O)O)=NN1 BBL032381 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 CC1=NNC([N+](=O)[O-])=C1 BBL013080 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.35 CC1=NOC(C(=O)O)=C1 BBL016103 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.35 CN1C=C(C(=O)Cl)C=N1 BBL041082 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.35 CN1C=CC(C(=O)Cl)=N1 BBL037396 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 NC(=O)C1=CC=C(Br)O1 BBL037288 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 NC1=CC(C(=O)O)=NN1 BBL038225 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.35 NC1=NC(C(=O)O)=CS1 BBL003682 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.35 NC1=NN=C(C(=O)O)N1 BBL001452 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 BBL014852 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 O=C(O)C1=CC(Br)=CS1 BBL038304 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.35 O=C(O)C1=CC(Cl)=CN1 BBL025690 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.35 O=C(O)C1=CC(Cl)=NO1 BBL029454 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 O=C(O)C1=CC=C(Br)O1 BBL009134 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.35 O=C(O)C1=CC=C(Br)S1 BBL016317 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BBL037515 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.35 O=C(O)C1=CC=C(F)S1 BBL040753 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.35 O=C(O)C1=CN=C(Br)S1 BBL010885 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.35 O=C(O)C1=CSC(Br)=N1 BBL010836 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.35 O=C(O)C1=NNC(Br)=N1 BBL031758 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.35 O=C(O)C1=NNC(O)=N1 BBL025792 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 O=C1C=C(C(=O)O)NN1 BBL010248 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.35 O=C1NC=C(C(=O)O)N1 BBL003459 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.1 CC1=CC=C(C=O)N1 BBL011859 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.1 CC1=NC(CN)=CS1 BBL030475 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.1 CN1C=CC(C=O)=N1 BBL104309 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.1 NC1=NC=C(C=O)S1 BBL013302 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.1 O=CC1=CC=C(Br)S1 BBL012655 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.1 O=CC1=CC=C(Cl)S1 BBL037784 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.1 O=CC1=CN=C(Br)S1 BBL030098 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.7 CC(=O)C1=CC=CN1 BBL010104 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.7 O=C(Cl)C1=CC=CS1 BBL011388 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.7 O=C(Cl)C1=CSN=N1 BBL010219 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.7 O=C(O)C1=CC=CO1 BBL009679 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.7 O=C(O)C1=CNN=C1 BBL104304 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.7 O=C(O)C1=COC=C1 BBL025800 [1,0,0,0,0,0|0,1,0]=2 47 B8R1.7 O=C(O)C1=CSN=N1 BBL010216 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.7 O=C(O)C1=NN=CN1 BBL033501 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.14 CC1=CC(C(=O)NN)=CS1 BBL017214 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.14 CC1=CC(C(=O)NN)=NO1 BBL016191 [0,1,0,0,0,0|2,1,0]=4 51 B10R1.14 CC1=CC=C(C(=O)NN)S1 BBL017585 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.14 CC1=NNC(C(=O)NN)=C1 BBL012753 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.14 CCC(=O)C1=CC=C(C)S1 BBL016562 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.14 CCC(=O)C1=CN(C)N=C1 BBL034962 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.14 CN1C=C(C(=O)NN)C=N1 BBL038668 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.14 COC(=O)C1=CC=C(Br)O1 BBL009127 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.14 COC(=O)C1=NN(C)C=C1 BBL039022 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.14 COC(=O)C1=NNC(C)=C1 BBL030093 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.14 COC(=O)C1=NNC(C)=N1 BBL035269 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.14 COC(=O)C1=NNC(N)=C1 BBL040969 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.31 C=CN1C=C(C(=O)O)C=N1 BBL032186 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.31 CCC1=CC(C(=O)Cl)=CS1 BBL014950 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.31 CCC1=CC(C(=O)O)=CS1 BBL015797 [0,1,0,0,0,0|0,0,0]=1 64 B10R1.31 CCC1=CC(C(=O)O)=NO1 BBL015883 [0,1,0,0,0,0|1,1,0]=3 65 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 BBL014956 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.31 CCC1=CC=C(C(=O)O)S1 BBL028250 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.31 CCN1C=C(C(=O)O)C=N1 BBL015059 [0,1,0,0,0,0|2,0,0]=3 68 B10R1.31 CCN1C=C(C(C)=O)C=N1 BBL016189 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.31 CCN1C=CC(C(=O)O)=N1 BBL001450 [0,1,0,0,0,0|3,0,0]=4 70 B10R1.31 N#CC1=CNC(C(=O)O)=C1 BBL025905 [0,1,0,0,0,0|2,0,1]=4 71 B10R1.31 O=C(O)C1=CC=C(CO)O1 BBL015780 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.31 O=C(O)C1=CN(CO)N=C1 BBL010160 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.31 O=C(O)C1=NN(CO)C=C1 BBL039248 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 BBL038338 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.59 CC(=O)C1=CC(C)=NN1C BBL038942 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.59 CC(=O)C1=CN(C)N=C1C BBL039652 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 BBL031666 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.59 CC1=C(C(=O)O)SC(Cl)=N1 BBL030132 [0,1,0,0,0,0|3,0,0]=4 79 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 BBL005562 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.59 CC1=C(C(=O)O)SC(O)=N1 BBL036810 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 BBL014856 [0,1,0,0,0,0|1,1,0]=3 82 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 BBL012869 [0,1,0,0,0,0|1,0,0]=2 83 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 BBL014473 [0,1,0,0,0,0|0,1,0]=2 84 B10R1.59 CC1=CC(C(=O)O)=C(N)S1 BBL015798 [0,1,0,0,0,0|0,0,0]=1 85 B10R1.59 CC1=CC(C(N)=O)=C(N)S1 BBL025808 [0,1,0,0,0,0|1,0,0]=2 86 B10R1.59 CC1=NC(C(=O)O)=C(C)S1 BBL031605 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 BBL030451 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.59 CC1=NN(C)C=C1C(=O)Cl BBL037776 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.59 CN1C=C(Br)C=C1C(=O)O BBL030879 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.59 CN1C=C(Cl)C=C1C(=O)O BBL025924 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 BBL039420 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.59 CN1C=C(N)C(C(=O)O)=N1 BBL039761 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.59 CN1N=C(N)C=C1C(=O)O BBL040299 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.59 O=C(O)C1=C(Br)C=C(Br)S1 BBL100128 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.194 CC1=C(Br)C(C(=O)O)=NN1 BBL011308 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.194 CC1=C(C(=O)O)NNC1=O BBL031926 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.194 CC1=C(C)C(C(=O)Cl)=CS1 BBL014947 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 BBL016567 [0,1,0,0,0,0|0,0,0]=1 99 B10R1.194 CC1=C(Cl)C(C(=O)O)=NN1 BBL013035 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.194 CC1=NNC(C(=O)O)=C1I BBL032834 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.194 CC1=NNC(C(N)=O)=C1Br BBL034956 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.194 CN1N=CC(C(=O)O)=C1N BBL029100 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.194 NC1=NNC(C(=O)O)=C1Cl BBL039460 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.194 O=C(O)C1=C(Br)C(Br)=NN1 BBL039262 [0,1,0,0,0,0|3,0,0]=4 105 B8R0.23 C=C(CC(=O)O)C(=O)O BBL011584 [0,0,1,0,0,0|1,1,1]=4 106 B8R0.23 C\C(=C/C(=O)O)C(=O)O BBL023435 [0,0,1,0,0,0|1,1,1]=4 107 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 BBL013140 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BBL027306 [0,0,0,0,0,1|2,0,0]=3 109 B10R1.13 CC1=CC=C(C(N)=O)C=N1 BBL100086 [0,0,0,0,0,1|2,0,0]=3 110 B10R1.13 NC(=O)C1=CC=C(N)C=C1 BBL011581 [0,0,0,0,0,1|3,0,0]=4 111 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BBL018585 [0,0,0,0,0,1|2,0,0]=3 112 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 BBL011385 [0,0,0,0,0,1|3,0,0]=4 113 B10R1.13 O=C(O)C1=CC=C(O)C=C1 BBL011981 [0,0,0,0,0,1|2,0,0]=3 114 B10R1.13 O=C1C=CC(C(=O)O)=CN1 BBL001444 [0,0,0,0,0,1|2,0,0]=3 115 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BBL009090 [0,0,0,0,0,1|1,1,0]=3 116 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BBL015079 [0,0,0,0,0,1|3,0,0]=4 117 B10R1.54 CC1=CN(CC(=O)O)N=C1 BBL029986 [0,0,0,0,0,1|3,0,0]=4 118 B10R1.54 CC1=NC(CC(=O)O)=CS1 BBL029738 [0,0,0,0,0,1|1,0,0]=2 119 B10R1.54 CC1=NN(CC(=O)O)C=C1 BBL013042 [0,0,0,0,0,1|3,0,0]=4 120 B10R1.54 NC(=O)CC1=CSC(N)=N1 BBL013261 [0,0,0,0,0,1|3,0,0]=4 121 B10R1.54 NC1=NC(CC(=O)O)=CS1 BBL008947 [0,0,0,0,0,1|2,0,0]=3 122 B10R1.54 O=C(O)CC1=CC(=O)NN1 BBL034976 [0,0,0,0,0,1|3,0,0]=4 123 B10R1.113 CC(=O)C1=CC=CC(O)=C1 BBL010535 [0,0,0,0,0,1|3,0,0]=4 124 B10R1.113 CC1=CC=CC(C(=O)O)=N1 BBL023748 [0,0,0,0,0,1|2,0,0]=3 125 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 BBL028416 [0,0,0,0,0,1|3,0,0]=4 126 B10R1.113 NC(=O)C1=CC(N)=CC=C1 BBL027669 [0,0,0,0,0,1|3,0,0]=4 127 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BBL011806 [0,0,0,0,0,1|2,0,0]=3 128 B10R1.113 NC1=CC=CC(C(=O)O)=C1 BBL037339 [0,0,0,0,0,1|2,0,0]=3 129 B10R1.113 NC1=NC=CC(C(=O)O)=C1 BBL009435 [0,0,0,0,0,1|2,0,0]=3 130 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 BBL025793 [0,0,0,0,0,1|2,0,0]=3 131 B10R1.113 O=C(O)C1=CC(O)=CC=C1 BBL011983 [0,0,0,0,0,1|2,0,0]=3 132 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BBL010930 [0,0,0,0,0,1|2,0,0]=3 133 B10R1.113 O=C(O)C1=CC=C[N+]([O-])=C1 BBL012227 [0,0,0,0,0,1|3,0,0]=4 134 B10R1.113 O=C(O)C1=NC(O)=CC=C1 BBL010816 [0,0,0,0,0,1|3,0,0]=4 135 B7R0.4 CCC\C=C/C(=O)O BBL029832 [1,0,1,0,0,0|1,0,1]=4 136 B7R0.4 C\C=C\C=C/C(=O)O BBL011617 [1,0,1,0,0,0|1,0,0]=3 137 B7R1.1 O=CC1=CN=CN1 BBL029981 [2,0,0,0,0,0|2,0,0]=4 138 B7R1.1 O=CC1=CNN=C1 BBL038290 [2,0,0,0,0,0|2,0,0]=4 139 B7R1.1 O=CC1=CSC=C1 BBL012656 [2,0,0,0,0,0|0,0,0]=2 140 B7R1.2 CC1=CC(O)=NO1 BBL033480 [2,0,0,0,0,0|1,1,0]=4 141 B9R1.21 CCC1=CC=C(C=O)S1 BBL040916 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.22 CC1=CC(C=O)=C(C)N1 BBL012646 [1,1,0,0,0,0|1,0,0]=3 143 B9R1.22 CC1=CC(C=O)=C(C)S1 BBL039889 [1,1,0,0,0,0|0,0,0]=2 144 B9R1.22 CC1=NN(C)C(C=O)=C1 BBL104313 [1,1,0,0,0,0|2,0,0]=4 145 B9R1.23 CC1=C(Br)C=C(C=O)S1 BBL104319 [1,1,0,0,0,0|2,0,0]=4 146 B9R1.23 CC1=CC(C=O)=NN1C BBL039105 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.132 CC1=CC=C(C=O)N1C BBL012642 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.11 COC(=O)C1=CNN=C1 BBL038232 [1,1,0,0,0,0|2,0,0]=4 149 B9R1.11 N\C(=N/O)C1=CSC=C1 BBL018149 [1,1,0,0,0,0|1,0,0]=3 150 B9R1.41 CC1=NNC=C1C(=O)O BBL011874 [1,1,0,0,0,0|2,0,0]=4 151 B9R1.41 NC(=O)C1=C(N)SC=C1 BBL013529 [1,1,0,0,0,0|1,0,0]=3 152 B9R1.41 NC1=C(C(=O)O)C=NN1 BBL018009 [1,1,0,0,0,0|2,0,0]=4 153 B9R1.41 O=C(O)C1=C(I)C=NN1 BBL016065 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 BBL027748 [0,1,0,0,0,1|2,0,0]=4 155 B11R1.3 COC1=NC=C(C(=O)O)C=C1 BBL004515 [0,1,0,0,0,1|1,0,0]=3 156 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 BBL009965 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BBL008190 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 BBL013694 [0,1,0,0,0,1|1,0,1]=4 159 B11R1.21 CC1=CC=C(C(=O)O)C=C1N BBL009326 [0,1,0,0,0,1|1,0,0]=3 160 B11R1.21 CC1=CC=C(C(N)=O)C=C1N BBL025656 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] BBL009924 [0,1,0,0,0,1|1,0,0]=3 162 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 BBL010301 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 BBL012255 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.21 NC1=CC(C(=O)O)=CC=C1Br BBL025694 [0,1,0,0,0,1|2,0,0]=4 165 B11R1.21 NC1=CC(C(=O)O)=CC=C1F BBL028248 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.21 NC1=CC=C(C(=O)O)C=C1S BBL030856 [0,1,0,0,0,1|2,0,0]=4 167 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 BBL010023 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 BBL010021 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 BBL011050 [0,1,0,0,0,1|2,0,0]=4 170 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 BBL012232 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.22 COC(=O)C1=CC=C(O)C=C1 BBL005648 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BBL028630 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.166 CC1=CC=C(C(N)=O)C(Cl)=N1 BBL028336 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.166 CC1=NC(N)=NC=C1C(=O)O BBL011823 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.166 NC1=C(C(=O)O)C=NC(S)=N1 BBL028755 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 BBL011914 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 BBL011673 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BBL010102 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.166 O=C(O)C1=CN=C(O)N=C1O BBL012114 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 BBL009640 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.39 COC(=O)CC1=CSC(C)=N1 BBL031555 [0,1,0,0,0,1|1,0,0]=3 182 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 BBL008738 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.23 CC1=CC=CC(\C(N)=N\O)=C1 BBL006558 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 BBL029467 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.74 CC1=CC(C(=O)O)=CC(=O)N1 BBL031017 [0,1,0,0,0,1|1,0,0]=3 186 B11R1.74 CC1=NC(O)=NC(C(=O)O)=C1 BBL030988 [0,1,0,0,0,1|1,0,0]=3 187 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 BBL011969 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 BBL019762 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BBL004463 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 BBL013050 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.159 CC1=CC=CC(C(=O)O)=C1O BBL023681 [0,1,0,0,0,1|1,0,0]=3 192 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BBL018907 [0,1,0,0,0,1|2,0,0]=4 193 B11R1.159 O=C(O)C1=CC=CC(F)=C1F BBL027777 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1F BBL030207 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.167 CC1=CC=C(O)C(C(=O)O)=C1 BBL027383 [0,1,0,0,0,1|1,0,0]=3 196 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 BBL027665 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 BBL027662 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.167 NC1=CC=C(F)C(C(=O)O)=C1 BBL028158 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.167 NC1=CC=C(F)C=C1C(=O)O BBL010568 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.167 NC1=CC=C(I)C=C1C(=O)O BBL027663 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 BBL013046 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O BBL007983 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O BBL009282 [0,1,0,0,0,1|2,0,0]=4 204 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F BBL100255 [0,1,0,0,0,1|2,0,0]=4 205 B11R1.167 O=C(O)C1=CC(I)=CC=C1I BBL035879 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.167 O=C(O)C1=CC(O)=CC=C1O BBL013232 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.266 COC1=NC=CC(C(=O)O)=C1 BBL013255 [0,1,0,0,0,1|1,0,0]=3 208 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 BBL010150 [0,1,0,0,0,1|1,0,0]=3 209 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BBL104328 [0,1,0,0,0,1|1,0,0]=3 210 B11R1.15 CCOC(=O)C1=CC(C)=NN1 BBL008948 [0,2,0,0,0,0|2,0,0]=4 211 B11R1.15 CCOC(=O)C1=CC(C)=NO1 BBL004014 [0,2,0,0,0,0|2,0,0]=4 212 B11R1.15 CCOC(=O)C1=CSC(N)=N1 BBL007566 [0,2,0,0,0,0|2,0,0]=4 213 B11R1.15 CCOC(=O)C1=NOC(C)=C1 BBL008537 [0,2,0,0,0,0|1,1,0]=4 214 B11R1.44 CCC1=CC(C(=O)NN)=CS1 BBL016194 [0,2,0,0,0,0|1,0,0]=3 215 B11R1.44 COC(=O)C1=CC(CCl)=CS1 BBL010192 [0,2,0,0,0,0|2,0,0]=4 216 B11R1.44 COC(=O)C1=CC=C(CCl)O1 BBL007187 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.44 COC(=O)C1=CC=C(CN)O1 BBL030685 [0,2,0,0,0,0|2,0,0]=4 218 B11R1.44 COC(=O)C1=CN(CCl)N=C1 BBL039986 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.225 COC(=O)C1=CC(C)=NN1C BBL030468 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.865 CC1=C(C)C(C(=O)NN)=CS1 BBL016677 [0,2,0,0,0,0|1,0,0]=3 221 B11R1.865 COC(=O)C1=C(Cl)C(C)=NN1 BBL036512 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.865 COC(=O)C1=C(I)C(C)=NN1 BBL036513 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.865 COC(=O)C1=NNC(C)=C1Br BBL011309 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BBL039180 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.48 CCN1N=C(C(=O)O)C=C1C BBL031015 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.50 CCN1C=C(C(=O)O)C(C)=N1 BBL013038 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.50 CNC1=NC(C)=C(C(=O)O)S1 BBL029772 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.50 COC1=NC(C)=C(C(=O)O)S1 BBL011121 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.124 CCCC1=CC(C(=O)Cl)=CS1 BBL014951 [0,2,0,0,0,0|1,0,0]=3 230 B11R1.124 CCCC1=CC(C(=O)O)=CS1 BBL013931 [0,2,0,0,0,0|0,0,0]=2 231 B11R1.124 CCCC1=CC(C(=O)O)=NN1 BBL031087 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.124 CCCC1=CC(C(=O)O)=NO1 BBL039456 [0,2,0,0,0,0|1,1,0]=4 233 B11R1.124 CCCN1C=C(C(=O)O)C=N1 BBL040020 [0,2,0,0,0,0|2,0,0]=4 234 B11R1.124 CCSC1=CC=C(C(=O)O)S1 BBL040755 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.124 COCC1=CC=C(C(=O)O)O1 BBL030264 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.124 NCCN1C=C(C(=O)O)C=N1 BBL041006 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.124 O=C(O)C1=CN(CCO)N=C1 BBL104352 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.175 CC(C)C1=CC(C(=O)Cl)=CS1 BBL014952 [0,2,0,0,0,0|1,0,0]=3 239 B11R1.175 CC(C)C1=CC(C(=O)O)=CS1 BBL016195 [0,2,0,0,0,0|0,0,0]=2 240 B11R1.175 CC(C)C1=NNC(C(=O)O)=C1 BBL008246 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 BBL030073 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.473 CCC1=NNC(C(=O)O)=C1Br BBL035089 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.473 CCN1N=CC(C(=O)O)=C1C BBL013036 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.49 CCN1N=C(C)C=C1C(=O)O BBL010154 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.673 CC1=C(C)C(C(N)=O)=C(N)S1 BBL005475 [0,2,0,0,0,0|1,0,0]=3 246 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br BBL013086 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.64 CCC1=C(C)SC=C1C(=O)Cl BBL014948 [0,2,0,0,0,0|1,0,0]=3 248 B11R1.64 CCC1=C(C)SC=C1C(=O)O BBL016193 [0,2,0,0,0,0|0,0,0]=2 249 B11R1.64 COC1=C(C(=O)O)SC=C1C BBL041000 [0,2,0,0,0,0|2,0,0]=4 250 B9R1.6 O=C(O)C1=CC=CN=C1 BBL037343 [0,0,1,1,0,0|1,0,1]=4 251 B9R1.13 O=C(O)CC1=CSC=C1 BBL025878 [1,0,0,0,0,1|0,0,0]=2 252 B9R1.13 O=C(O)CN1C=CN=C1 BBL001468 [1,0,0,0,0,1|2,0,0]=4 253 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BBL018950 [0,0,0,0,0,2|2,0,0]=4 254 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 BBL027456 [0,0,0,0,0,2|2,0,0]=4 255 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 BBL023058 [0,0,0,0,0,2|2,0,0]=4