0 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 MC41231 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 MC41229 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 CS20410 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 MC41240 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.21 CC(=O)C1=CC(C)=C(Cl)N=C1 MC115594 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 CS21693 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 CS15561 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 CS10715 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 CS18939 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 CS22282 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 CS16308 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 CS10813 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 CS10863 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.21 CC(=O)c1ccc(Br)c(Br)c1 MC433228 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.21 CC(=O)c1ccc(Cl)c(F)c1 MC433221 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.21 CC(=O)c1ccc(Cl)c(N)c1 MC433203 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.21 CC(=O)c1ccc(F)c(F)c1 CS19019 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.21 CC(=O)c1ccc(F)c(N)c1 MC433205 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 MC443561 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.21 CC(O)C1=CC(F)=C(F)C=C1 MC40732 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 CS20811 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 CS20182 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 MC433136 [0,0,0,0,0,0|2,0,0]=2 23 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=N1 MC431672 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 MC41013 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 MC41503 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 CS20467 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 CS21076 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.21 CC1=C(C)C=C([N+](=O)[O-])C=C1 CS19756 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 MC111082 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 CS16867 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 MC20279 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 CS20828 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.21 CC1=C(Cl)C=C(C(=O)[O-])C=C1 MC40343 [0,0,0,0,0,0|2,0,1]=3 34 B11R1.21 CC1=C(Cl)C=C([N+](=O)[O-])C=C1 MC41509 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 MC433626 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 CS19324 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 CS13608 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.21 CC1=C(Cl)N=C(C(=O)O)C=C1 CS14760 [0,0,0,0,0,0|3,0,0]=3 39 B11R1.21 CC1=C(Cl)N=CC(C(=O)O)=C1 MC429982 [0,0,0,0,0,0|3,0,0]=3 40 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 CS20351 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 CS21927 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.21 CC1=C(F)C=C([N+](=O)[O-])C=C1 CS10432 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 CS20353 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.21 CC1=C(F)C=CC(C(=O)Cl)=C1 MC40481 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 CS14298 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 CS12903 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.21 CC1=C(F)C=CC([N+](=O)[O-])=C1 CS10433 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.21 CC1=C(I)C=C(C(=O)Cl)C=C1 MC433702 [0,0,0,0,0,0|3,0,0]=3 49 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 CS21937 [0,0,0,0,0,0|2,0,0]=2 50 B11R1.21 CC1=C(I)C=C([N+](=O)[O-])C=C1 MC434021 [0,0,0,0,0,0|3,0,1]=4 51 B11R1.21 CC1=C(I)C=CC([N+](=O)[O-])=C1 MC442250 [0,0,0,0,0,0|3,0,1]=4 52 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 CS21906 [0,0,0,0,0,0|2,0,0]=2 53 B11R1.21 CC1=C(N)C=C([N+](=O)[O-])C=C1 CS16439 [0,0,0,0,0,0|3,0,1]=4 54 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 CS21001 [0,0,0,0,0,0|2,0,0]=2 55 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 MC442887 [0,0,0,0,0,0|2,0,1]=3 56 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 CS20943 [0,0,0,0,0,0|1,0,0]=1 57 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 MC20541 [0,0,0,0,0,0|3,0,1]=4 58 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 CS10489 [0,0,0,0,0,0|2,0,1]=3 59 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 MC441420 [0,0,0,0,0,0|2,0,1]=3 60 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 CS20947 [0,0,0,0,0,0|1,0,0]=1 61 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=C1 MC433397 [0,0,0,0,0,0|2,0,1]=3 62 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br CS17571 [0,0,0,0,0,0|3,0,0]=3 63 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1O CS19382 [0,0,0,0,0,0|3,0,1]=4 64 B11R1.21 CC1=CC=C(C(=O)O)NC1=O CS16105 [0,0,0,0,0,0|2,0,1]=3 65 B11R1.21 CC1=CN=C(C(=O)O)C=C1Br MC432004 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.21 CC1=CN=C(C(=O)O)C=C1Cl CS17916 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1O MC105052 [0,0,0,0,0,0|3,0,1]=4 68 B11R1.21 CC1=[N+]([O-])C=C(C(=O)O)N=C1 CS14626 [0,0,0,0,0,0|3,0,1]=4 69 B11R1.21 CN1N=CC(C(=O)O)=CC1=O MC116439 [0,0,0,0,0,0|3,0,1]=4 70 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 CS12919 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.21 NC(=O)C1=NC(Br)=C(Cl)C=C1 MC108007 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.21 NC(=O)C1=NC(Cl)=C(Br)C=C1 MC108013 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.21 NC(=O)C1=NC(Cl)=C(Cl)C=C1 MC110050 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 MC40225 [0,0,0,0,0,0|2,0,0]=2 75 B11R1.21 NC1=C(Br)C=C([N+](=O)[O-])C=C1 CS18699 [0,0,0,0,0,0|3,0,1]=4 76 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 MC33100 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.21 NC1=C(Br)C=CC([N+](=O)[O-])=C1 CS19006 [0,0,0,0,0,0|3,0,1]=4 78 B11R1.21 NC1=C(Cl)C=C([N+](=O)[O-])C=C1 CS13557 [0,0,0,0,0,0|3,0,1]=4 79 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 CS20206 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.21 NC1=C(Cl)C=CC([N+](=O)[O-])=C1 CS15374 [0,0,0,0,0,0|3,0,1]=4 81 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 CS20228 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.21 NC1=C(F)C=C([N+](=O)[O-])C=C1 MC30236 [0,0,0,0,0,0|3,0,1]=4 83 B11R1.21 NC1=C(F)C=CC(B(O)O)=C1 MC442908 [0,0,0,0,0,0|3,0,1]=4 84 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 CS10439 [0,0,0,0,0,0|2,0,0]=2 85 B11R1.21 NC1=C(F)C=CC([N+](=O)[O-])=C1 CS22987 [0,0,0,0,0,0|3,0,1]=4 86 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 MC10142 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.21 NC1=C(I)C=C([N+](=O)[O-])C=C1 CS19223 [0,0,0,0,0,0|3,0,1]=4 88 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 MC31156 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.21 NC1=C(I)C=CC([N+](=O)[O-])=C1 CS16498 [0,0,0,0,0,0|3,0,1]=4 90 B11R1.21 NC1=C(I)N=C(C(=O)O)C=N1 MC104768 [0,0,0,0,0,0|4,0,0]=4 91 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 CS20381 [0,0,0,0,0,0|2,0,0]=2 92 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 CS20332 [0,0,0,0,0,0|1,0,0]=1 93 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 CS10491 [0,0,0,0,0,0|1,0,0]=1 94 B11R1.21 NC1=C(O)C=CC([N+](=O)[O-])=C1 MC41144 [0,0,0,0,0,0|2,0,1]=3 95 B11R1.21 NC1=C(S)C=C([N+](=O)[O-])C=C1 MC427263 [0,0,0,0,0,0|2,1,1]=4 96 B11R1.21 NC1=CC(C(=O)O)=NC=C1F MC431827 [0,0,0,0,0,0|3,0,0]=3 97 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl MC20248 [0,0,0,0,0,0|2,0,0]=2 98 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1N CS16440 [0,0,0,0,0,0|3,0,1]=4 99 B11R1.21 NC1=NC=C(C(=O)O)C=C1Br CS12387 [0,0,0,0,0,0|3,0,0]=3 100 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br MC101922 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.21 NC1=NC=C([N+](=O)[O-])C=C1O CS15633 [0,0,0,0,0,0|3,0,1]=4 102 B11R1.21 Nc1cc(C(=O)O)ncc1Br MC104060 [0,0,0,0,0,0|3,0,0]=3 103 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 MC21024 [0,0,0,0,0,0|3,0,0]=3 104 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 MC30275 [0,0,0,0,0,0|3,0,0]=3 105 B11R1.21 O=C(Cl)C1=CC(F)=C(Br)C=C1 MC40445 [0,0,0,0,0,0|3,0,0]=3 106 B11R1.21 O=C(Cl)C1=CC(F)=C(Cl)C=C1 MC40454 [0,0,0,0,0,0|3,0,0]=3 107 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 MC30095 [0,0,0,0,0,0|3,0,0]=3 108 B11R1.21 O=C(Cl)C1=NC(Br)=C(F)C=C1 MC106017 [0,0,0,0,0,0|4,0,0]=4 109 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 CS13169 [0,0,0,0,0,0|1,0,1]=2 110 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 MC433643 [0,0,0,0,0,0|2,0,0]=2 111 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 CS19835 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 CS21914 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 CS16354 [0,0,0,0,0,0|2,0,0]=2 114 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 MC40236 [0,0,0,0,0,0|2,0,0]=2 115 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 CS14672 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 CS19962 [0,0,0,0,0,0|2,0,0]=2 117 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 CS20110 [0,0,0,0,0,0|1,0,0]=1 118 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 CS21990 [0,0,0,0,0,0|2,0,0]=2 119 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 CS19967 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 CS20015 [0,0,0,0,0,0|2,0,0]=2 121 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 CS22285 [0,0,0,0,0,0|2,0,0]=2 122 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 MC40282 [0,0,0,0,0,0|1,0,0]=1 123 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 MC441218 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 MC434062 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 CS12746 [0,0,0,0,0,0|2,0,0]=2 126 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 MC441219 [0,0,0,0,0,0|2,0,0]=2 127 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 CS22662 [0,0,0,0,0,0|1,0,0]=1 128 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS20111 [0,0,0,0,0,0|1,0,0]=1 129 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 MC40283 [0,0,0,0,0,0|1,0,0]=1 130 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 CS18380 [0,0,0,0,0,0|1,0,0]=1 131 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 CS20259 [0,0,0,0,0,0|0,0,0]=0 132 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 CS16864 [0,0,0,0,0,0|2,0,1]=3 133 B11R1.21 O=C(O)C1=CC=C(O)C(=O)N1 CS17670 [0,0,0,0,0,0|1,0,1]=2 134 B11R1.21 O=C(O)C1=CN=C(Br)C(Br)=C1 MC20828 [0,0,0,0,0,0|3,0,0]=3 135 B11R1.21 O=C(O)C1=CN=C(Br)C(F)=C1 MC431134 [0,0,0,0,0,0|3,0,0]=3 136 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 CS14093 [0,0,0,0,0,0|3,0,0]=3 137 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 CS22861 [0,0,0,0,0,0|3,0,0]=3 138 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 MC432210 [0,0,0,0,0,0|3,0,0]=3 139 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 CS13277 [0,0,0,0,0,0|3,0,0]=3 140 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 MC103666 [0,0,0,0,0,0|3,0,0]=3 141 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 CS13224 [0,0,0,0,0,0|3,0,0]=3 142 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 CS15048 [0,0,0,0,0,0|3,0,0]=3 143 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 CS15050 [0,0,0,0,0,0|3,0,0]=3 144 B11R1.21 O=C(O)C1=NC(Cl)=C(O)C=C1 MC432469 [0,0,0,0,0,0|2,0,0]=2 145 B11R1.21 O=C(O)C1=NC(O)=C(F)C=C1 CS17967 [0,0,0,0,0,0|2,0,0]=2 146 B11R1.21 O=C(O)C1=NC(O)=C(O)N=C1 CS17143 [0,0,0,0,0,0|2,0,0]=2 147 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 CS15157 [0,0,0,0,0,0|3,0,0]=3 148 B11R1.21 O=C(O)C1=NC=C(Cl)C(Br)=C1 MC430521 [0,0,0,0,0,0|3,0,0]=3 149 B11R1.21 O=C(O)C1=NC=C(O)C(Cl)=C1 MC432602 [0,0,0,0,0,0|2,0,0]=2 150 B11R1.21 O=C([O-])C1=CC(Cl)=C(F)C=C1 MC40342 [0,0,0,0,0,0|2,0,1]=3 151 B11R1.21 O=C([O-])C1=CC(F)=C(F)C=C1 MC40348 [0,0,0,0,0,0|2,0,1]=3 152 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(Br)C=C1 CS17243 [0,0,0,0,0,0|3,0,1]=4 153 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(F)C=C1 CS22855 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(I)C=C1 CS16203 [0,0,0,0,0,0|3,0,1]=4 155 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(O)C=C1 CS18789 [0,0,0,0,0,0|2,0,1]=3 156 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Br)C=C1 CS20647 [0,0,0,0,0,0|3,0,1]=4 157 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 CS18855 [0,0,0,0,0,0|2,0,1]=3 158 B11R1.21 O=[N+]([O-])C1=CC(F)=C(Cl)C=C1 CS22876 [0,0,0,0,0,0|3,0,1]=4 159 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)C=C1 MC30320 [0,0,0,0,0,0|2,0,1]=3 160 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Br)C=C1 MC33152 [0,0,0,0,0,0|2,0,1]=3 161 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 CS22922 [0,0,0,0,0,0|2,0,1]=3 162 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 CS21551 [0,0,0,0,0,0|2,0,1]=3 163 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Br)=C1 CS18763 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Cl)=C1 CS22206 [0,0,0,0,0,0|3,0,1]=4 165 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(F)=C1 MC432598 [0,0,0,0,0,0|3,0,1]=4 166 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(I)=C1 MC429508 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.21 O=[N+]([O-])c1ccc(Br)c(F)c1 CS22859 [0,0,0,0,0,0|3,0,1]=4 168 B11R1.21 O=[N+]([O-])c1ccc(Br)c(I)c1 MC41572 [0,0,0,0,0,0|3,0,1]=4 169 B11R1.21 O=[N+]([O-])c1ccc(Cl)c(Br)c1 CS18655 [0,0,0,0,0,0|3,0,1]=4 170 B11R1.21 O=[N+]([O-])c1ccc(Cl)c(Cl)c1 MC41580 [0,0,0,0,0,0|3,0,1]=4 171 B11R1.21 O=[N+]([O-])c1ccc(F)c(Cl)c1 CS22872 [0,0,0,0,0,0|3,0,1]=4 172 B11R1.21 O=[N+]([O-])c1ccc(F)c(F)c1 CS22881 [0,0,0,0,0,0|3,0,1]=4 173 B11R1.21 O=[N+]([O-])c1ccc(F)c(I)c1 MC41583 [0,0,0,0,0,0|3,0,1]=4 174 B11R1.21 O=[N+]([O-])c1ccc(I)c(F)c1 MC433529 [0,0,0,0,0,0|3,0,1]=4 175 B11R1.21 OB(O)C1=CC(Br)=C(Cl)C=C1 MC41811 [0,0,0,0,0,0|3,0,1]=4 176 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 CS18935 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 CS18946 [0,0,0,0,0,0|3,0,1]=4 178 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 CS13191 [0,0,0,0,0,0|2,0,1]=3 179 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 CS18957 [0,0,0,0,0,0|3,0,1]=4 180 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 MC441708 [0,0,0,0,0,0|2,0,1]=3 181 B11R1.21 OB(O)C1=CC(F)=C(O)N=C1 MC114150 [0,0,0,0,0,0|3,0,1]=4 182 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 CS16283 [0,0,0,0,0,0|2,0,1]=3 183 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 MC441422 [0,0,0,0,0,0|2,0,1]=3 184 B10R1.13 C=C(C)C1=CC=C(O)C=C1 MC441020 [1,0,0,0,0,0|2,0,0]=3 185 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS19447 [1,0,0,0,0,0|2,0,0]=3 186 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS17999 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [1,0,0,0,0,0|2,0,0]=3 188 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS20014 [1,0,0,0,0,0|2,0,0]=3 189 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS19687 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS14299 [1,0,0,0,0,0|2,0,0]=3 191 B10R1.13 CC(=O)C1=CC=C(F)N=C1 CS16982 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.13 CC(=O)C1=CC=C(N)C=C1 MC20162 [1,0,0,0,0,0|2,0,0]=3 193 B10R1.13 CC(=O)C1=CC=C(O)C=C1 CS22884 [1,0,0,0,0,0|1,0,0]=2 194 B10R1.13 CC(=O)C1=CC=C(O)N=C1 CS12692 [1,0,0,0,0,0|2,0,0]=3 195 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [1,0,0,0,0,0|3,0,0]=4 196 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CS16977 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS16979 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.13 CC(=O)C1=NC=C(F)C=C1 MC106404 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.13 CC(=O)C1=NC=C(N)C=C1 MC442802 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.13 CC(=O)c1ccc(I)cc1 MC433245 [1,0,0,0,0,0|2,0,0]=3 202 B10R1.13 CC(O)C1=CC=C(F)C=C1 MC33129 [1,0,0,0,0,0|2,0,1]=4 203 B10R1.13 CC(O)C1=CC=C(N)C=C1 MC40728 [1,0,0,0,0,0|2,0,1]=4 204 B10R1.13 CC1=CC=C(B(O)O)C=C1 CS10128 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.13 CC1=CC=C(C(=N)N)C=C1 CS20439 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 MC40494 [1,0,0,0,0,0|2,0,0]=3 207 B10R1.13 CC1=CC=C(C(=O)O)C=C1 MC40304 [1,0,0,0,0,0|1,0,0]=2 208 B10R1.13 CC1=CC=C(C(N)=O)C=C1 CS11895 [1,0,0,0,0,0|2,0,0]=3 209 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS11896 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.13 CC1=CC=C(S(N)=O)C=C1 CS18822 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS10458 [1,0,0,0,0,0|2,0,0]=3 212 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS17310 [1,0,0,0,0,0|2,0,0]=3 213 B10R1.13 CC1=CN=C(C(=O)O)C=N1 CS19370 [1,0,0,0,0,0|3,0,0]=4 214 B10R1.13 CC1=CN=C(C(=O)O)N=C1 CS21764 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS20324 [1,0,0,0,0,0|2,0,0]=3 216 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CS21698 [1,0,0,0,0,0|3,0,0]=4 217 B10R1.13 CC1=NC=C(C(N)=O)C=C1 CS18427 [1,0,0,0,0,0|3,0,0]=4 218 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS16528 [1,0,0,0,0,0|3,0,0]=4 219 B10R1.13 CN(C)C1=CC=C(O)C=C1 MC442505 [1,0,0,0,0,0|3,0,0]=4 220 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 MC21022 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS20283 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.13 N=C(N)C1=CC=C(F)C=C1 CS18318 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.13 N=C(N)C1=CC=C(N)C=C1 CS21974 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS10426 [1,0,0,0,0,0|2,0,0]=3 225 B10R1.13 NC(=O)C1=CN=C(N)C=C1 MC425266 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.13 NC(=O)C1=CNC(=O)C=C1 MC427340 [1,0,0,0,0,0|2,0,1]=4 227 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 MC41603 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 MC33351 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.13 NC(=O)C1=NC=C(F)C=C1 CS16336 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.13 NC(=O)C1=NC=C(N)C=C1 CS10223 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS20343 [1,0,0,0,0,0|1,1,0]=3 232 B10R1.13 NC1=CC=C(B(O)O)C=C1 CS19513 [1,0,0,0,0,0|2,0,1]=4 233 B10R1.13 NC1=CC=C(B(O)O)C=C1 MC442888 [1,0,0,0,0,0|2,0,1]=4 234 B10R1.13 NC1=CC=C(C(=O)O)C=C1 MC40224 [1,0,0,0,0,0|1,0,0]=2 235 B10R1.13 NC1=CC=C(C(=O)O)N=N1 MC444236 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 CS22580 [1,0,0,0,0,0|1,0,1]=3 237 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 MC40934 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS19367 [1,0,0,0,0,0|2,0,0]=3 239 B10R1.13 NC1=CN=C(C(=O)O)C=N1 CS14292 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.13 NC1=CN=C(C(=O)O)N=C1 MC115893 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CS19354 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.13 NC1=NC=C(C(=O)O)C=N1 CS18230 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 MC40440 [1,0,0,0,0,0|2,0,0]=3 244 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 MC40474 [1,0,0,0,0,0|2,0,0]=3 245 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 MC433701 [1,0,0,0,0,0|2,0,0]=3 246 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 CS20082 [1,0,0,0,0,0|1,0,0]=2 247 B10R1.13 O=C(O)C1=CC=C(Br)N=N1 MC431375 [1,0,0,0,0,0|3,0,0]=4 248 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS15821 [1,0,0,0,0,0|1,0,0]=2 249 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 MC444427 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.13 O=C(O)C1=CC=C(F)C=C1 MC40280 [1,0,0,0,0,0|1,0,0]=2 251 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS20135 [1,0,0,0,0,0|1,0,0]=2 252 B10R1.13 O=C(O)C1=CC=C(O)C=C1 CS22885 [1,0,0,0,0,0|0,0,0]=1 253 B10R1.13 O=C(O)C1=CC=C(O)N=N1 CS17550 [1,0,0,0,0,0|2,0,0]=3 254 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 CS22092 [1,0,0,0,0,0|2,0,0]=3 255 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CS22101 [1,0,0,0,0,0|2,0,0]=3 256 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 CS18270 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CS18891 [1,0,0,0,0,0|2,0,0]=3 258 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CS19189 [1,0,0,0,0,0|1,0,0]=2 259 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS22033 [1,0,0,0,0,0|2,0,0]=3 260 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 CS14223 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 CS12377 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS19376 [1,0,0,0,0,0|2,0,0]=3 263 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 CS14727 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 CS10354 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.13 O=C(O)C1=NC=C(F)C=C1 CS10387 [1,0,0,0,0,0|2,0,0]=3 266 B10R1.13 O=C(O)C1=NC=C(F)C=N1 MC103707 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.13 O=C(O)C1=NC=C(I)C=C1 CS10412 [1,0,0,0,0,0|2,0,0]=3 268 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS22997 [1,0,0,0,0,0|1,0,0]=2 269 B10R1.13 O=C(O)C1=NC=C(O)C=N1 MC105798 [1,0,0,0,0,0|2,0,0]=3 270 B10R1.13 O=C([O-])C1=CC=C(Br)C=C1 MC40334 [1,0,0,0,0,0|1,0,1]=3 271 B10R1.13 O=C([O-])C1=CC=C(Cl)C=C1 MC40337 [1,0,0,0,0,0|1,0,1]=3 272 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 MC40351 [1,0,0,0,0,0|1,0,1]=3 273 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 CS18786 [1,0,0,0,0,0|2,0,1]=4 274 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 CS22843 [1,0,0,0,0,0|2,0,1]=4 275 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 CS19234 [1,0,0,0,0,0|2,0,1]=4 276 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 MC41207 [1,0,0,0,0,0|1,0,1]=3 277 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 CS19719 [1,0,0,0,0,0|2,0,1]=4 278 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 CS22717 [1,0,0,0,0,0|2,0,1]=4 279 B10R1.13 O=[N+]([O-])c1ccc(Cl)cc1 MC41577 [1,0,0,0,0,0|2,0,1]=4 280 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CS19222 [1,0,0,0,0,0|2,0,1]=4 281 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 CS19227 [1,0,0,0,0,0|2,0,1]=4 282 B10R1.13 OB(O)C1=CC=C(F)C=C1 CS23000 [1,0,0,0,0,0|2,0,1]=4 283 B10R1.13 OB(O)C1=CC=C(I)C=C1 CS22011 [1,0,0,0,0,0|2,0,1]=4 284 B10R1.13 OB(O)C1=CC=C(O)C=C1 CS19452 [1,0,0,0,0,0|1,0,1]=3 285 B10R1.13 OB(O)C1=CC=C(S)C=C1 MC20067 [1,0,0,0,0,0|1,1,1]=4 286 B10R1.13 OC1=CC=C(C(F)F)C=C1 CS15692 [1,0,0,0,0,0|2,0,1]=4 287 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 CS18865 [1,0,0,0,0,0|2,0,0]=3 288 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS18282 [1,0,0,0,0,0|3,0,0]=4 289 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS16656 [1,0,0,0,0,0|3,0,0]=4 290 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS18206 [1,0,0,0,0,0|3,0,0]=4 291 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS19798 [1,0,0,0,0,0|2,0,0]=3 292 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 MC116273 [1,0,0,0,0,0|3,0,0]=4 293 B10R1.113 CC(=O)C1=CC(F)=CC=C1 CS19067 [1,0,0,0,0,0|2,0,0]=3 294 B10R1.113 CC(=O)C1=CC(F)=CN=C1 MC443199 [1,0,0,0,0,0|3,0,0]=4 295 B10R1.113 CC(=O)C1=CC(I)=CC=C1 MC33049 [1,0,0,0,0,0|2,0,0]=3 296 B10R1.113 CC(=O)C1=CC(N)=CC=C1 CS19441 [1,0,0,0,0,0|2,0,0]=3 297 B10R1.113 CC(=O)C1=CC(O)=CC=C1 CS18681 [1,0,0,0,0,0|1,0,0]=2 298 B10R1.113 CC(=O)C1=CC=CC(C)=C1 CS19159 [1,0,0,0,0,0|2,0,0]=3 299 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 CS17202 [1,0,0,0,0,0|3,0,0]=4 300 B10R1.113 CC(=O)C1=NC(C)=CC=C1 CS18426 [1,0,0,0,0,0|3,0,0]=4 301 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 MC441210 [1,0,0,0,0,0|3,0,0]=4 302 B10R1.113 CC(=O)C1=NC=CC(F)=C1 MC430529 [1,0,0,0,0,0|3,0,0]=4 303 B10R1.113 CC(=O)C1=NC=CC(O)=N1 MC430457 [1,0,0,0,0,0|3,0,0]=4 304 B10R1.113 CC(N)C1=CC=CC(O)=C1 MC431437 [1,0,0,0,0,0|2,0,1]=4 305 B10R1.113 CC(O)C1=CC(Br)=CC=C1 MC40729 [1,0,0,0,0,0|2,0,1]=4 306 B10R1.113 CC(O)C1=CC(F)=CC=C1 MC433887 [1,0,0,0,0,0|2,0,1]=4 307 B10R1.113 CC(O)C1=CC(N)=CC=C1 CS21787 [1,0,0,0,0,0|2,0,1]=4 308 B10R1.113 CC1=CC(B(O)O)=CC=C1 CS10529 [1,0,0,0,0,0|2,0,1]=4 309 B10R1.113 CC1=CC(C(=O)O)=CN=C1 CS20319 [1,0,0,0,0,0|2,0,0]=3 310 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS22984 [1,0,0,0,0,0|2,0,0]=3 311 B10R1.113 CC1=CC(C(N)=O)=CN=C1 MC33520 [1,0,0,0,0,0|3,0,0]=4 312 B10R1.113 CC1=CC=CC(C(=N)N)=C1 CS20438 [1,0,0,0,0,0|3,0,0]=4 313 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 MC20748 [1,0,0,0,0,0|2,0,0]=3 314 B10R1.113 CC1=CC=CC(C(=O)O)=C1 CS19799 [1,0,0,0,0,0|1,0,0]=2 315 B10R1.113 CC1=CC=CC(C(=O)O)=N1 CS16317 [1,0,0,0,0,0|2,0,0]=3 316 B10R1.113 CC1=CC=CC(C(O)=S)=C1 MC433710 [1,0,0,0,0,0|1,1,0]=3 317 B10R1.113 CC1=NC(C(=O)O)=CN=C1 MC10465 [1,0,0,0,0,0|3,0,0]=4 318 B10R1.113 CC1=NC(C(=O)O)=NC=C1 MC104691 [1,0,0,0,0,0|3,0,0]=4 319 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS19546 [1,0,0,0,0,0|2,0,0]=3 320 B10R1.113 CC1=NC=CC(C(=O)O)=N1 CS19716 [1,0,0,0,0,0|3,0,0]=4 321 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 CS20273 [1,0,0,0,0,0|3,0,0]=4 322 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 CS22167 [1,0,0,0,0,0|2,0,0]=3 323 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 CS17785 [1,0,0,0,0,0|3,0,0]=4 324 B10R1.113 NC(=O)C1=CC(N)=CC=C1 MC433795 [1,0,0,0,0,0|2,0,0]=3 325 B10R1.113 NC(=O)C1=CC(N)=CN=C1 CS15231 [1,0,0,0,0,0|3,0,0]=4 326 B10R1.113 NC(=O)C1=CC(N)=NC=C1 MC425286 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 CS19001 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 MC427450 [1,0,0,0,0,0|3,0,0]=4 329 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 MC20489 [1,0,0,0,0,0|3,0,0]=4 330 B10R1.113 NC(=O)C1=NC=CC(N)=C1 MC116216 [1,0,0,0,0,0|3,0,0]=4 331 B10R1.113 NC1=CC(C(=O)O)=CN=C1 CS22022 [1,0,0,0,0,0|2,0,0]=3 332 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CS15431 [1,0,0,0,0,0|2,0,0]=3 333 B10R1.113 NC1=CC(C(=O)O)=NC=N1 MC425236 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 CS22379 [1,0,0,0,0,0|2,0,1]=4 335 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS11047 [1,0,0,0,0,0|2,0,1]=4 336 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS18152 [1,0,0,0,0,0|2,0,1]=4 337 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS19512 [1,0,0,0,0,0|2,0,1]=4 338 B10R1.113 NC1=CC=CC(B(O)O)=C1 MC20897 [1,0,0,0,0,0|2,0,1]=4 339 B10R1.113 NC1=CC=CC(C(=O)O)=C1 CS13396 [1,0,0,0,0,0|1,0,0]=2 340 B10R1.113 NC1=CC=CC(C(=O)O)=N1 CS19355 [1,0,0,0,0,0|2,0,0]=3 341 B10R1.113 NC1=CN=CC(C(=O)O)=N1 CS12628 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.113 NC1=NC=CC(C(=O)O)=C1 CS23021 [1,0,0,0,0,0|2,0,0]=3 343 B10R1.113 NC1=NC=CC(C(=O)O)=N1 MC10396 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 MC40439 [1,0,0,0,0,0|2,0,0]=3 345 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 MC40449 [1,0,0,0,0,0|2,0,0]=3 346 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 MC40473 [1,0,0,0,0,0|2,0,0]=3 347 B10R1.113 O=C(Cl)C1=NC=CC(O)=C1 MC106015 [1,0,0,0,0,0|2,0,0]=3 348 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 CS15122 [1,0,0,0,0,0|1,0,0]=2 349 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 MC20488 [1,0,0,0,0,0|2,0,0]=3 350 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 CS14882 [1,0,0,0,0,0|1,0,0]=2 351 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 CS18845 [1,0,0,0,0,0|2,0,0]=3 352 B10R1.113 O=C(O)C1=CC(F)=CC=C1 CS10368 [1,0,0,0,0,0|1,0,0]=2 353 B10R1.113 O=C(O)C1=CC(F)=NC=C1 CS18886 [1,0,0,0,0,0|2,0,0]=3 354 B10R1.113 O=C(O)C1=CC(I)=CC=C1 CS10375 [1,0,0,0,0,0|1,0,0]=2 355 B10R1.113 O=C(O)C1=CC(O)=CC=C1 CS19800 [1,0,0,0,0,0|0,0,0]=1 356 B10R1.113 O=C(O)C1=CC(S)=CC=C1 MC20304 [1,0,0,0,0,0|0,1,0]=2 357 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 CS22040 [1,0,0,0,0,0|2,0,0]=3 358 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 CS18852 [1,0,0,0,0,0|2,0,0]=3 359 B10R1.113 O=C(O)C1=CN=CC(F)=C1 CS22934 [1,0,0,0,0,0|2,0,0]=3 360 B10R1.113 O=C(O)C1=CN=CC(O)=C1 CS22067 [1,0,0,0,0,0|1,0,0]=2 361 B10R1.113 O=C(O)C1=CN=NC(Cl)=C1 CS17230 [1,0,0,0,0,0|3,0,0]=4 362 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS22087 [1,0,0,0,0,0|2,0,0]=3 363 B10R1.113 O=C(O)C1=NC(Br)=CN=C1 MC441120 [1,0,0,0,0,0|3,0,0]=4 364 B10R1.113 O=C(O)C1=NC(Br)=NC=C1 MC443368 [1,0,0,0,0,0|3,0,0]=4 365 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 CS21854 [1,0,0,0,0,0|2,0,0]=3 366 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 CS12423 [1,0,0,0,0,0|3,0,0]=4 367 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 CS17265 [1,0,0,0,0,0|3,0,0]=4 368 B10R1.113 O=C(O)C1=NC(F)=CC=C1 CS14295 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.113 O=C(O)C1=NC(O)=CC=C1 CS22114 [1,0,0,0,0,0|1,0,0]=2 370 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 CS14122 [1,0,0,0,0,0|2,0,0]=3 371 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 CS14963 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CS17501 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CS17506 [1,0,0,0,0,0|2,0,0]=3 374 B10R1.113 O=C(O)C1=NC=CC(O)=C1 CS22894 [1,0,0,0,0,0|1,0,0]=2 375 B10R1.113 O=C(O)C1=NC=NC(Cl)=C1 MC444429 [1,0,0,0,0,0|3,0,0]=4 376 B10R1.113 O=C(O)C1=NC=NC(O)=C1 CS17537 [1,0,0,0,0,0|2,0,0]=3 377 B10R1.113 O=C([O-])C1=CC(Cl)=CC=C1 MC40336 [1,0,0,0,0,0|1,0,1]=3 378 B10R1.113 O=C([O-])C1=CC(F)=CC=C1 MC40350 [1,0,0,0,0,0|1,0,1]=3 379 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 MC430296 [1,0,0,0,0,0|2,0,1]=4 380 B10R1.113 O=C1C=C(C(=O)O)C=NN1 CS22119 [1,0,0,0,0,0|2,0,1]=4 381 B10R1.113 O=C1C=NC=C(C(=O)O)N1 CS17150 [1,0,0,0,0,0|2,0,1]=4 382 B10R1.113 O=C1N=CC=C(C(=O)O)N1 CS12225 [1,0,0,0,0,0|2,0,1]=4 383 B10R1.113 O=[N+]([O-])C1=CC(O)=NC=C1 CS21588 [1,0,0,0,0,0|2,0,1]=4 384 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 CS20650 [1,0,0,0,0,0|2,0,1]=4 385 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 CS20664 [1,0,0,0,0,0|2,0,1]=4 386 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 CS20684 [1,0,0,0,0,0|2,0,1]=4 387 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 CS19240 [1,0,0,0,0,0|2,0,1]=4 388 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 CS22383 [1,0,0,0,0,0|1,0,1]=3 389 B10R1.113 O=[N+]([O-])C1=CN=CC(O)=C1 CS22322 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 CS21711 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.113 OB(O)C1=CC(Br)=CC=C1 CS19219 [1,0,0,0,0,0|2,0,1]=4 392 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 CS22999 [1,0,0,0,0,0|2,0,1]=4 393 B10R1.113 OB(O)C1=CC(F)=CC=C1 CS21930 [1,0,0,0,0,0|2,0,1]=4 394 B10R1.113 OB(O)C1=CC(O)=CC=C1 MC440047 [1,0,0,0,0,0|1,0,1]=3 395 B10R1.113 OB(O)C1=CC(O)=CN=C1 MC114947 [1,0,0,0,0,0|2,0,1]=4 396 B10R1.113 OB(O)C1=CC(O)=NC=C1 MC114099 [1,0,0,0,0,0|2,0,1]=4 397 B10R1.113 OC1=CC(C(F)F)=CC=C1 MC432160 [1,0,0,0,0,0|2,0,1]=4 398 B10R1.176 C=CC1=CC(F)=C(F)C=C1 CS19052 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 MC41096 [1,0,0,0,0,0|2,0,0]=3 400 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 MC431775 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.176 CC1=C(Br)C=C(CO)C=C1 MC33229 [1,0,0,0,0,0|2,0,1]=4 402 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CS22664 [1,0,0,0,0,0|2,0,0]=3 403 B10R1.176 CC1=C(Br)C=CC(CO)=C1 MC111151 [1,0,0,0,0,0|2,0,1]=4 404 B10R1.176 CC1=C(C)C=C(C=O)C=C1 MC33166 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.176 CC1=C(C)C=C(CO)C=C1 MC40706 [1,0,0,0,0,0|2,0,1]=4 406 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 MC433130 [1,0,0,0,0,0|2,0,0]=3 407 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 MC433419 [1,0,0,0,0,0|2,0,0]=3 408 B10R1.176 CC1=C(F)C=C(C=O)C=C1 MC33065 [1,0,0,0,0,0|2,0,0]=3 409 B10R1.176 CC1=C(F)C=CC(C=O)=C1 MC41117 [1,0,0,0,0,0|2,0,0]=3 410 B10R1.176 CC1=C(F)C=CC(C=O)=N1 CS12797 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.176 CC1=C(O)C=C(C#N)C=C1 CS10986 [1,0,0,0,0,0|2,0,1]=4 412 B10R1.176 CC1=C(O)C=C(C=O)C=C1 MC41122 [1,0,0,0,0,0|1,0,0]=2 413 B10R1.176 CC1=C(O)C=CC(C#N)=C1 CS17416 [1,0,0,0,0,0|2,0,1]=4 414 B10R1.176 CC1=C(O)C=CC(C=O)=C1 CS20934 [1,0,0,0,0,0|1,0,0]=2 415 B10R1.176 CC1=C(O)C=CC(CN)=C1 MC445599 [1,0,0,0,0,0|2,0,1]=4 416 B10R1.176 CC1=CC(C=O)=CN=C1O MC442266 [1,0,0,0,0,0|2,0,0]=3 417 B10R1.176 CC1=CN=C(C=O)C=C1Br MC102712 [1,0,0,0,0,0|3,0,0]=4 418 B10R1.176 CC1=NC=C(C=O)C=C1F MC431247 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.176 CC1=NC=C(C=O)C=C1O MC430648 [1,0,0,0,0,0|2,0,0]=3 420 B10R1.176 CCC1=CC(N)=C(O)C=C1 MC442496 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 MC432619 [1,0,0,0,0,0|2,0,1]=4 422 B10R1.176 CCC1=CC(O)=C(N)C=C1 CS16266 [1,0,0,0,0,0|2,0,1]=4 423 B10R1.176 CCC1=CC=C(O)C(O)=C1 MC441226 [1,0,0,0,0,0|1,0,1]=3 424 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC30339 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC41160 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.176 COC1=CC(C)=C(O)C=C1 CS15470 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.176 COC1=CC(Cl)=C(O)C=C1 CS20293 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.176 COC1=CC(F)=C(O)C=C1 MC441061 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.176 COC1=CC(N)=C(O)C=C1 CS21254 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.176 COC1=CC(O)=C(Br)C=C1 CS21376 [1,0,0,0,0,0|3,0,0]=4 431 B10R1.176 COC1=CC(O)=C(Cl)C=C1 MC442395 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.176 COC1=CC(O)=C(F)C=C1 MC430013 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.176 COC1=CC(O)=C(N)C=C1 CS21584 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.176 COC1=CC=C(O)C(O)=C1 MC442392 [1,0,0,0,0,0|2,0,0]=3 435 B10R1.176 Cn1ccc(C=O)cc1=O MC103763 [1,0,0,0,0,0|2,0,1]=4 436 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 CS10311 [1,0,0,0,0,0|2,0,1]=4 437 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 CS18887 [1,0,0,0,0,0|2,0,1]=4 438 B10R1.176 N#CC1=CC(F)=C(O)C=C1 CS14303 [1,0,0,0,0,0|2,0,1]=4 439 B10R1.176 N#CC1=CC(N)=C(O)C=C1 CS21247 [1,0,0,0,0,0|2,0,1]=4 440 B10R1.176 N#CC1=CC(O)=C(Br)C=C1 MC442777 [1,0,0,0,0,0|2,0,1]=4 441 B10R1.176 N#CC1=CC(O)=C(Cl)C=C1 MC441026 [1,0,0,0,0,0|2,0,1]=4 442 B10R1.176 N#CC1=CC(O)=C(F)C=C1 CS20043 [1,0,0,0,0,0|2,0,1]=4 443 B10R1.176 N#CC1=CC(O)=C(I)C=C1 MC433781 [1,0,0,0,0,0|2,0,1]=4 444 B10R1.176 N#CC1=CC(O)=C(N)C=C1 CS22562 [1,0,0,0,0,0|2,0,1]=4 445 B10R1.176 N#CC1=CC(O)=C(O)C=C1 MC20147 [1,0,0,0,0,0|1,0,1]=3 446 B10R1.176 NC1=NC=C(C=O)C=C1Br MC432272 [1,0,0,0,0,0|3,0,0]=4 447 B10R1.176 NCC1=CC(O)=C(O)C=C1 MC425646 [1,0,0,0,0,0|1,0,1]=3 448 B10R1.176 O=C1C=C(CO)OC=C1O CS11536 [1,0,0,0,0,0|1,0,2]=4 449 B10R1.176 O=CC1=CC(Br)=C(Br)C=C1 MC430425 [1,0,0,0,0,0|2,0,0]=3 450 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 CS12700 [1,0,0,0,0,0|2,0,0]=3 451 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 CS10229 [1,0,0,0,0,0|2,0,0]=3 452 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 MC20184 [1,0,0,0,0,0|1,0,0]=2 453 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 CS12259 [1,0,0,0,0,0|2,0,0]=3 454 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 CS19889 [1,0,0,0,0,0|2,0,0]=3 455 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 MC20026 [1,0,0,0,0,0|2,0,0]=3 456 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 CS10232 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 CS10264 [1,0,0,0,0,0|2,0,0]=3 458 B10R1.176 O=CC1=CC(F)=C(F)C=C1 CS14168 [1,0,0,0,0,0|2,0,0]=3 459 B10R1.176 O=CC1=CC(F)=C(I)C=C1 CS10296 [1,0,0,0,0,0|2,0,0]=3 460 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CS10367 [1,0,0,0,0,0|1,0,0]=2 461 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 MC431061 [1,0,0,0,0,0|2,0,0]=3 462 B10R1.176 O=CC1=CC(I)=C(Cl)C=C1 MC441220 [1,0,0,0,0,0|2,0,0]=3 463 B10R1.176 O=CC1=CC(I)=C(F)C=C1 MC20286 [1,0,0,0,0,0|2,0,0]=3 464 B10R1.176 O=CC1=CC(I)=C(I)C=C1 MC431060 [1,0,0,0,0,0|2,0,0]=3 465 B10R1.176 O=CC1=CC(I)=C(O)C=C1 MC429971 [1,0,0,0,0,0|1,0,0]=2 466 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 MC41092 [1,0,0,0,0,0|1,0,0]=2 467 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 CS15259 [1,0,0,0,0,0|1,0,0]=2 468 B10R1.176 O=CC1=CC(O)=C(F)C=C1 MC41115 [1,0,0,0,0,0|1,0,0]=2 469 B10R1.176 O=CC1=CC(O)=C(O)C=C1 CS18720 [1,0,0,0,0,0|0,0,0]=1 470 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 CS18127 [1,0,0,0,0,0|3,0,0]=4 471 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 MC33386 [1,0,0,0,0,0|3,0,0]=4 472 B10R1.176 O=CC1=CNC(=O)C(Br)=C1 MC430621 [1,0,0,0,0,0|2,0,1]=4 473 B10R1.176 O=CC1=CNC(=O)C(Cl)=C1 MC430658 [1,0,0,0,0,0|2,0,1]=4 474 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 MC40686 [1,0,0,0,0,0|2,0,1]=4 475 B10R1.176 OCC1=CC(Br)=C(O)C=C1 CS21356 [1,0,0,0,0,0|1,0,1]=3 476 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 CS18809 [1,0,0,0,0,0|2,0,1]=4 477 B10R1.176 OCC1=CC(Cl)=C(F)C=C1 MC30274 [1,0,0,0,0,0|2,0,1]=4 478 B10R1.176 OCC1=CC(F)=C(Br)C=C1 CS20190 [1,0,0,0,0,0|2,0,1]=4 479 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 MC40694 [1,0,0,0,0,0|2,0,1]=4 480 B10R1.176 OCC1=CC(F)=C(F)C=C1 CS19362 [1,0,0,0,0,0|2,0,1]=4 481 B10R1.176 OCC1=CC(O)=C(Br)C=C1 CS16027 [1,0,0,0,0,0|1,0,1]=3 482 B10R1.176 OCC1=CC(O)=C(I)C=C1 MC33283 [1,0,0,0,0,0|1,0,1]=3 483 B12R1.23 NC1=C(O)C=CC(S(N)(=O)=O)=C1 CS16410 [0,1,0,0,0,0|2,0,1]=4 484 B12R1.23 OC1=CC=C(C(F)(F)F)C=C1O MC442386 [0,1,0,0,0,0|2,0,1]=4 485 B12R1.48 CC(=O)C1=CC(Br)=C(C#N)C=C1 MC433722 [0,1,0,0,0,0|3,0,0]=4 486 B12R1.48 CC(=O)C1=CC(C)=C(C#N)C=C1 MC433227 [0,1,0,0,0,0|3,0,0]=4 487 B12R1.48 CC1=C(C#N)C=CC(C(=O)O)=C1 CS15153 [0,1,0,0,0,0|2,0,0]=3 488 B12R1.48 CC1=C(C#N)C=CC(C(=O)O)=N1 MC431550 [0,1,0,0,0,0|3,0,0]=4 489 B12R1.48 CCC1=C(N)C=C(C(=O)O)C=C1 CS14645 [0,1,0,0,0,0|2,0,0]=3 490 B12R1.48 CNC1=C(Br)C=C(C(=O)O)C=C1 CS17356 [0,1,0,0,0,0|2,0,0]=3 491 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 MC111592 [0,1,0,0,0,0|2,0,0]=3 492 B12R1.48 COC1=C(Br)C=C(C(C)=O)C=C1 CS11019 [0,1,0,0,0,0|2,0,0]=3 493 B12R1.48 COC1=C(Br)C=C(C(N)=O)C=N1 MC100060 [0,1,0,0,0,0|3,0,0]=4 494 B12R1.48 COC1=C(Br)C=C([N+](=O)[O-])C=C1 MC41322 [0,1,0,0,0,0|2,0,1]=4 495 B12R1.48 COC1=C(Br)N=C(C(=O)O)C=C1 CS10651 [0,1,0,0,0,0|2,0,0]=3 496 B12R1.48 COC1=C(C)C=C(B(O)O)C=C1 MC442901 [0,1,0,0,0,0|2,0,1]=4 497 B12R1.48 COC1=C(C)C=C(C(=O)O)C=C1 MC30268 [0,1,0,0,0,0|1,0,0]=2 498 B12R1.48 COC1=C(C)C=C(C(C)=O)C=C1 MC41263 [0,1,0,0,0,0|2,0,0]=3 499 B12R1.48 COC1=C(C)C=C([N+](=O)[O-])C=C1 MC433395 [0,1,0,0,0,0|2,0,1]=4 500 B12R1.48 COC1=C(Cl)C=C(B(O)O)C=C1 MC441429 [0,1,0,0,0,0|2,0,1]=4 501 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 MC30277 [0,1,0,0,0,0|1,0,0]=2 502 B12R1.48 COC1=C(Cl)C=C([N+](=O)[O-])C=C1 CS20211 [0,1,0,0,0,0|2,0,1]=4 503 B12R1.48 COC1=C(F)C=C(B(O)O)C=C1 CS21926 [0,1,0,0,0,0|2,0,1]=4 504 B12R1.48 COC1=C(F)C=C(C(=O)Cl)C=C1 MC40477 [0,1,0,0,0,0|2,0,0]=3 505 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 MC30258 [0,1,0,0,0,0|1,0,0]=2 506 B12R1.48 COC1=C(F)C=C(C(C)=O)C=N1 MC429308 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.48 COC1=C(F)C=C([N+](=O)[O-])C=C1 MC33142 [0,1,0,0,0,0|2,0,1]=4 508 B12R1.48 COC1=C(I)C=C([N+](=O)[O-])C=C1 MC41344 [0,1,0,0,0,0|2,0,1]=4 509 B12R1.48 COC1=C(N)C=C(B(O)O)C=C1 MC441496 [0,1,0,0,0,0|2,0,1]=4 510 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 MC40229 [0,1,0,0,0,0|1,0,0]=2 511 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 CS15591 [0,1,0,0,0,0|2,0,1]=4 512 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 MC40927 [0,1,0,0,0,0|2,0,1]=4 513 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 MC113665 [0,1,0,0,0,0|1,0,1]=3 514 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 CS10864 [0,1,0,0,0,0|0,0,0]=1 515 B12R1.48 COC1=C(O)C=C(C(C)=O)C=C1 CS22927 [0,1,0,0,0,0|1,0,0]=2 516 B12R1.48 COC1=C(O)C=C([N+](=O)[O-])C=C1 CS15430 [0,1,0,0,0,0|1,0,1]=3 517 B12R1.48 COC1=CN=C(C(=O)O)C=C1Cl MC104263 [0,1,0,0,0,0|2,0,0]=3 518 B12R1.48 COC1=CN=C(C(=O)O)C=C1O MC431993 [0,1,0,0,0,0|1,0,0]=2 519 B12R1.48 COC1=NC=C(C(=O)O)C=C1Cl MC20740 [0,1,0,0,0,0|2,0,0]=3 520 B12R1.48 COC1=NC=C(C(=O)O)C=C1F CS13290 [0,1,0,0,0,0|2,0,0]=3 521 B12R1.48 COc1ccc(C(C)=O)cc1F MC30259 [0,1,0,0,0,0|2,0,0]=3 522 B12R1.48 N#CC1=C(F)C=C(C(=O)O)C=C1 CS13841 [0,1,0,0,0,0|2,0,0]=3 523 B12R1.48 NC1=C(CO)C=CC([N+](=O)[O-])=C1 CS20384 [0,1,0,0,0,0|2,0,1]=4 524 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 MC442234 [0,1,0,0,0,0|1,0,1]=3 525 B12R1.48 O=CC1=C(O)C=C(C(=O)O)C=C1 CS18398 [0,1,0,0,0,0|0,0,1]=2 526 B12R1.48 O=CC1=C(O)C=C(C(=O)O)C=C1 MC427435 [0,1,0,0,0,0|0,0,1]=2 527 B12R1.48 O=CC1=C(O)C=C([N+](=O)[O-])C=C1 CS21587 [0,1,0,0,0,0|1,0,2]=4 528 B12R1.48 O=[N+]([O-])C1=CC(Cl)=C(CO)C=C1 CS21453 [0,1,0,0,0,0|2,0,1]=4 529 B12R1.48 O=[N+]([O-])C1=CC(F)=C(CO)C=C1 CS17621 [0,1,0,0,0,0|2,0,1]=4 530 B12R1.48 OCC1=C(Cl)C=C(B(O)O)C=C1 MC442041 [0,1,0,0,0,0|2,0,1]=4 531 B12R1.48 OCC1=C(F)C=C(B(O)O)C=C1 MC442040 [0,1,0,0,0,0|2,0,1]=4 532 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 MC442815 [0,1,0,0,0,0|2,0,0]=3 533 B12R1.56 CC(=O)C1=CC(C#N)=C(N)C=C1 MC433721 [0,1,0,0,0,0|3,0,0]=4 534 B12R1.56 CC1=C(CO)C=C(B(O)O)C=C1 MC111672 [0,1,0,0,0,0|2,0,1]=4 535 B12R1.56 CC1=NC=C(C(=O)O)C=C1C#N MC431587 [0,1,0,0,0,0|3,0,0]=4 536 B12R1.56 CCC1=C(Br)C=CC(C(=O)O)=C1 MC428381 [0,1,0,0,0,0|2,0,0]=3 537 B12R1.56 CCC1=C(N)C=CC(C(=O)O)=C1 MC30294 [0,1,0,0,0,0|2,0,0]=3 538 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 CS22663 [0,1,0,0,0,0|1,0,0]=2 539 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=N1 CS16863 [0,1,0,0,0,0|2,0,0]=3 540 B12R1.56 COC1=C(Br)C=CC([N+](=O)[O-])=C1 MC30087 [0,1,0,0,0,0|2,0,1]=4 541 B12R1.56 COC1=C(C)C=CC(B(O)O)=C1 MC21120 [0,1,0,0,0,0|2,0,1]=4 542 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 CS21939 [0,1,0,0,0,0|1,0,0]=2 543 B12R1.56 COC1=C(C)C=CC([N+](=O)[O-])=C1 CS10878 [0,1,0,0,0,0|2,0,1]=4 544 B12R1.56 COC1=C(Cl)C=CC(B(O)O)=C1 CS12284 [0,1,0,0,0,0|2,0,1]=4 545 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 CS20832 [0,1,0,0,0,0|1,0,0]=2 546 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=N1 CS13301 [0,1,0,0,0,0|2,0,0]=3 547 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 CS20212 [0,1,0,0,0,0|2,0,1]=4 548 B12R1.56 COC1=C(F)C=CC(B(O)O)=C1 CS12285 [0,1,0,0,0,0|2,0,1]=4 549 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 CS16067 [0,1,0,0,0,0|1,0,0]=2 550 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 MC30272 [0,1,0,0,0,0|2,0,0]=3 551 B12R1.56 COC1=C(F)C=CC([N+](=O)[O-])=C1 CS21550 [0,1,0,0,0,0|2,0,1]=4 552 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 MC20116 [0,1,0,0,0,0|2,0,1]=4 553 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 CS21016 [0,1,0,0,0,0|1,0,0]=2 554 B12R1.56 COC1=C(N)C=CC(C(=O)O)=N1 MC432347 [0,1,0,0,0,0|2,0,0]=3 555 B12R1.56 COC1=C(N)C=CC([N+](=O)[O-])=C1 CS16396 [0,1,0,0,0,0|2,0,1]=4 556 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 MC442694 [0,1,0,0,0,0|1,0,1]=3 557 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 CS20951 [0,1,0,0,0,0|0,0,0]=1 558 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 CS14549 [0,1,0,0,0,0|1,0,0]=2 559 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 CS20340 [0,1,0,0,0,0|1,0,1]=3 560 B12R1.56 COC1=CC([N+](=O)[O-])=CN=C1O MC431861 [0,1,0,0,0,0|2,0,1]=4 561 B12R1.56 N#CC1=C(Br)C=CC(C(=O)O)=C1 CS16346 [0,1,0,0,0,0|2,0,0]=3 562 B12R1.56 N#CC1=C(Cl)C=CC(C(=O)O)=C1 MC31025 [0,1,0,0,0,0|2,0,0]=3 563 B12R1.56 N#CC1=C(O)C=CC(C(=O)O)=C1 MC441018 [0,1,0,0,0,0|1,0,0]=2 564 B12R1.56 N#CC1=C(O)C=CC([N+](=O)[O-])=C1 MC442231 [0,1,0,0,0,0|2,0,1]=4 565 B12R1.56 O=CC1=C(F)C=CC(C(=O)O)=C1 CS22830 [0,1,0,0,0,0|1,0,1]=3 566 B12R1.56 O=[N+]([O-])C1=CC(CO)=C(F)C=C1 MC40714 [0,1,0,0,0,0|2,0,1]=4 567 B12R1.232 CC(=O)C1=C(Br)C=C(Br)C(F)=C1 MC108789 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.232 CC(=O)C1=C(Br)C=C(F)C(Br)=C1 MC108792 [0,1,0,0,0,0|3,0,0]=4 569 B12R1.232 CC(=O)C1=C(Cl)C=C(C)C(Cl)=C1 MC109831 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.232 CC(=O)C1=C(Cl)C=C(Cl)C(F)=C1 MC20164 [0,1,0,0,0,0|3,0,0]=4 571 B12R1.232 CC(=O)C1=C(F)C=C(Br)C(Br)=C1 MC108798 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.232 CC(=O)C1=C(F)C=C(F)C(Br)=C1 CS13026 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.232 CC(=O)C1=C(F)C=C(F)C(F)=C1 MC41273 [0,1,0,0,0,0|3,0,0]=4 574 B12R1.232 CC(=O)C1=C(O)C=C(Br)C(F)=C1 MC445714 [0,1,0,0,0,0|3,0,0]=4 575 B12R1.232 CC(=O)C1=C(O)C=C(Cl)C(F)=C1 MC101890 [0,1,0,0,0,0|3,0,0]=4 576 B12R1.232 CC(=O)C1=C(O)C=C(O)C(Cl)=C1 MC445475 [0,1,0,0,0,0|2,0,0]=3 577 B12R1.232 CC(=O)c1cc(F)c(Br)cc1F MC433214 [0,1,0,0,0,0|3,0,0]=4 578 B12R1.232 CC1=C(C(=O)O)C=C(F)C(F)=C1 MC433083 [0,1,0,0,0,0|2,0,0]=3 579 B12R1.232 CC1=C(C(N)=O)C=C(Cl)C(Cl)=C1 MC109842 [0,1,0,0,0,0|3,0,0]=4 580 B12R1.232 CC1=CC(Br)=C(C(=O)O)C=C1F MC20023 [0,1,0,0,0,0|2,0,0]=3 581 B12R1.232 CC1=CC(C(=O)Cl)=C(Cl)C=C1Cl MC109869 [0,1,0,0,0,0|3,0,0]=4 582 B12R1.232 CC1=CC(C(=O)O)=C(Br)C=C1F MC20021 [0,1,0,0,0,0|2,0,0]=3 583 B12R1.232 CC1=CC(C(=O)O)=C(Cl)N=C1C CS13795 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1Br CS22641 [0,1,0,0,0,0|2,0,0]=3 585 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1F CS20022 [0,1,0,0,0,0|2,0,0]=3 586 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1Br MC442289 [0,1,0,0,0,0|2,0,0]=3 587 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1C MC40317 [0,1,0,0,0,0|2,0,0]=3 588 B12R1.232 CC1=CC(Cl)=C(C(=O)Cl)C=C1Cl MC109871 [0,1,0,0,0,0|3,0,0]=4 589 B12R1.232 CC1=CC(Cl)=C(C(N)=O)C=C1Cl MC109839 [0,1,0,0,0,0|3,0,0]=4 590 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1F CS18575 [0,1,0,0,0,0|2,0,0]=3 591 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1O CS15678 [0,1,0,0,0,0|1,0,0]=2 592 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1C MC433576 [0,1,0,0,0,0|2,0,0]=3 593 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1O MC102236 [0,1,0,0,0,0|1,0,0]=2 594 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1I MC433697 [0,1,0,0,0,0|2,0,0]=3 595 B12R1.232 CC1=CC(O)=C(C)C=C1[N+](=O)[O-] MC41186 [0,1,0,0,0,0|2,0,1]=4 596 B12R1.232 NC(=O)C1=C(Cl)C=C(F)C(Cl)=C1 MC109602 [0,1,0,0,0,0|3,0,0]=4 597 B12R1.232 NC(=O)C1=C(F)C=C(Br)C(Br)=C1 MC108828 [0,1,0,0,0,0|3,0,0]=4 598 B12R1.232 NC(=O)C1=C(F)C=C(Cl)C(Cl)=C1 MC109606 [0,1,0,0,0,0|3,0,0]=4 599 B12R1.232 NC(=O)C1=C(F)C=C(F)C(Br)=C1 MC108402 [0,1,0,0,0,0|3,0,0]=4 600 B12R1.232 NC1=C(C(=O)O)C=C(Br)C(Br)=C1 MC433568 [0,1,0,0,0,0|2,0,0]=3 601 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Br)=C1 CS21240 [0,1,0,0,0,0|2,0,0]=3 602 B12R1.232 NC1=C(C(=O)O)C=C(F)C(Cl)=C1 CS15021 [0,1,0,0,0,0|2,0,0]=3 603 B12R1.232 NC1=C(C(=O)O)C=C(F)C(F)=C1 CS10345 [0,1,0,0,0,0|2,0,0]=3 604 B12R1.232 NC1=CC(C(=O)O)=C(Cl)C=C1Cl MC433570 [0,1,0,0,0,0|2,0,0]=3 605 B12R1.232 NC1=CC(Cl)=C(Cl)C=C1C(=O)O MC20250 [0,1,0,0,0,0|2,0,0]=3 606 B12R1.232 NC1=CC(F)=C(Br)N=C1C(=O)O MC432142 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.232 NC1=CC(F)=C(C(=O)O)C=C1F MC433079 [0,1,0,0,0,0|2,0,0]=3 608 B12R1.232 O=C(Cl)C1=C(Br)C=C(Br)C(F)=C1 MC108902 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.232 O=C(Cl)C1=C(Br)C=C(Cl)C(F)=C1 MC107942 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.232 O=C(Cl)C1=C(Br)C=C(F)C(Br)=C1 MC108904 [0,1,0,0,0,0|3,0,0]=4 611 B12R1.232 O=C(Cl)C1=C(Br)C=C(F)C(Cl)=C1 MC107945 [0,1,0,0,0,0|3,0,0]=4 612 B12R1.232 O=C(Cl)C1=C(Cl)C=C(Cl)C(F)=C1 MC433647 [0,1,0,0,0,0|3,0,0]=4 613 B12R1.232 O=C(Cl)C1=C(Cl)C=C(F)C(Br)=C1 MC107955 [0,1,0,0,0,0|3,0,0]=4 614 B12R1.232 O=C(Cl)C1=C(F)C=C(Br)C(Br)=C1 MC108910 [0,1,0,0,0,0|3,0,0]=4 615 B12R1.232 O=C(Cl)C1=C(F)C=C(Br)C(Cl)=C1 MC107953 [0,1,0,0,0,0|3,0,0]=4 616 B12R1.232 O=C(Cl)C1=C(F)C=C(Cl)C(F)=C1 MC433621 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.232 O=C(Cl)C1=C(F)C=C(F)C(F)=C1 MC40502 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.232 O=C(O)C1=C(Br)C=C(F)C(F)=C1 CS21347 [0,1,0,0,0,0|2,0,0]=3 619 B12R1.232 O=C(O)C1=C(Cl)C=C(Br)C(F)=C1 MC20020 [0,1,0,0,0,0|2,0,0]=3 620 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(Cl)=C1 CS19935 [0,1,0,0,0,0|2,0,0]=3 621 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(F)=C1 MC20018 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.232 O=C(O)C1=C(Cl)C=C(F)C(F)=C1 CS19681 [0,1,0,0,0,0|2,0,0]=3 623 B12R1.232 O=C(O)C1=C(Cl)N=C(Cl)C(Cl)=C1 CS16590 [0,1,0,0,0,0|3,0,0]=4 624 B12R1.232 O=C(O)C1=C(Cl)N=C(Cl)C(F)=C1 CS22833 [0,1,0,0,0,0|3,0,0]=4 625 B12R1.232 O=C(O)C1=C(F)C=C(Br)C(F)=C1 CS15117 [0,1,0,0,0,0|2,0,0]=3 626 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Br)=C1 CS10290 [0,1,0,0,0,0|2,0,0]=3 627 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Cl)=C1 CS14091 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(F)=C1 MC30314 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Br)=C1 CS15921 [0,1,0,0,0,0|2,0,0]=3 630 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Cl)=C1 CS19683 [0,1,0,0,0,0|2,0,0]=3 631 B12R1.232 O=C(O)C1=C(F)C=C(F)C(F)=C1 CS19752 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.232 O=C(O)C1=C(F)C=C(F)C(I)=C1 MC431229 [0,1,0,0,0,0|2,0,0]=3 633 B12R1.232 O=C(O)C1=C(F)N=C(F)C(F)=C1 MC102210 [0,1,0,0,0,0|3,0,0]=4 634 B12R1.232 O=C(O)C1=C(I)C=C(F)C(F)=C1 MC433137 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.232 O=C(O)C1=C(O)C=C(Cl)C(Cl)=C1 MC432263 [0,1,0,0,0,0|2,0,0]=3 636 B12R1.232 O=C(O)C1=NC(Cl)=C(Cl)C=C1Cl CS12975 [0,1,0,0,0,0|3,0,0]=4 637 B12R1.232 O=C([O-])C1=C(Cl)C=C(F)C(F)=C1 MC40338 [0,1,0,0,0,0|2,0,1]=4 638 B12R1.232 O=C([O-])C1=C(F)C=C(F)C(F)=C1 MC30147 [0,1,0,0,0,0|2,0,1]=4 639 B12R1.232 O=[N+]([O-])C1=CC(O)=C(Br)C=C1F CS18666 [0,1,0,0,0,0|2,0,1]=4 640 B12R1.232 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1Cl MC433380 [0,1,0,0,0,0|2,0,1]=4 641 B12R1.232 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1F CS22877 [0,1,0,0,0,0|2,0,1]=4 642 B12R1.232 O=[N+]([O-])C1=CC(O)=C(F)C=C1Br CS15967 [0,1,0,0,0,0|2,0,1]=4 643 B12R1.232 O=[N+]([O-])C1=CC(O)=C(F)C=C1F MC21056 [0,1,0,0,0,0|2,0,1]=4 644 B12R1.367 CC1=C(Br)C=CC(C(=O)CBr)=C1 MC113998 [0,1,0,0,0,0|3,0,0]=4 645 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 MC41281 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=C1 CS21663 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.367 COC(=O)C1=CC(Br)=C(I)C=C1 CS22151 [0,1,0,0,0,0|2,0,0]=3 648 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 CS13492 [0,1,0,0,0,0|2,0,0]=3 649 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 CS13829 [0,1,0,0,0,0|1,0,0]=2 650 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 CS13733 [0,1,0,0,0,0|2,0,0]=3 651 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 CS11642 [0,1,0,0,0,0|2,0,0]=3 652 B12R1.367 COC(=O)C1=CC(C)=C(F)C=C1 CS13467 [0,1,0,0,0,0|2,0,0]=3 653 B12R1.367 COC(=O)C1=CC(C)=C(I)C=C1 MC40109 [0,1,0,0,0,0|2,0,0]=3 654 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 CS13862 [0,1,0,0,0,0|2,0,0]=3 655 B12R1.367 COC(=O)C1=CC(Cl)=C(F)C=C1 CS14199 [0,1,0,0,0,0|2,0,0]=3 656 B12R1.367 COC(=O)C1=CC(Cl)=C(O)C=C1 MC40083 [0,1,0,0,0,0|1,0,0]=2 657 B12R1.367 COC(=O)C1=CC(F)=C(Br)C=C1 MC30260 [0,1,0,0,0,0|2,0,0]=3 658 B12R1.367 COC(=O)C1=CC(F)=C(C)C=C1 CS14385 [0,1,0,0,0,0|2,0,0]=3 659 B12R1.367 COC(=O)C1=CC(F)=C(Cl)C=C1 CS14421 [0,1,0,0,0,0|2,0,0]=3 660 B12R1.367 COC(=O)C1=CC(F)=C(F)C=C1 MC40097 [0,1,0,0,0,0|2,0,0]=3 661 B12R1.367 COC(=O)C1=CC(F)=C(F)N=C1 MC430145 [0,1,0,0,0,0|3,0,0]=4 662 B12R1.367 COC(=O)C1=CC(F)=C(N)C=C1 CS14018 [0,1,0,0,0,0|2,0,0]=3 663 B12R1.367 COC(=O)C1=CC(I)=C(C)C=C1 CS19409 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.367 COC(=O)C1=CC(I)=C(N)C=C1 CS18837 [0,1,0,0,0,0|2,0,0]=3 665 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 CS11645 [0,1,0,0,0,0|1,0,0]=2 666 B12R1.367 COC(=O)C1=CC(N)=C(Br)C=C1 CS11615 [0,1,0,0,0,0|2,0,0]=3 667 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 CS10899 [0,1,0,0,0,0|2,0,0]=3 668 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 CS11616 [0,1,0,0,0,0|2,0,0]=3 669 B12R1.367 COC(=O)C1=CC(N)=C(I)C=C1 CS11618 [0,1,0,0,0,0|2,0,0]=3 670 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 CS20450 [0,1,0,0,0,0|2,0,0]=3 671 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 CS11617 [0,1,0,0,0,0|1,0,0]=2 672 B12R1.367 COC(=O)C1=CC(O)=C(Br)C=C1 CS11639 [0,1,0,0,0,0|1,0,0]=2 673 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 CS15706 [0,1,0,0,0,0|1,0,0]=2 674 B12R1.367 COC(=O)C1=CC(O)=C(I)C=C1 CS11687 [0,1,0,0,0,0|1,0,0]=2 675 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 CS21024 [0,1,0,0,0,0|1,0,0]=2 676 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 CS20955 [0,1,0,0,0,0|0,0,0]=1 677 B12R1.367 COC(=O)C1=CC(S)=C(N)C=C1 MC427483 [0,1,0,0,0,0|1,1,0]=3 678 B12R1.367 COC(=O)C1=CN=C(Br)C(C)=C1 MC443715 [0,1,0,0,0,0|3,0,0]=4 679 B12R1.367 COC(=O)C1=CN=C(Br)C(F)=C1 MC430144 [0,1,0,0,0,0|3,0,0]=4 680 B12R1.367 COC(=O)C1=CN=C(Cl)C(Br)=C1 CS15946 [0,1,0,0,0,0|3,0,0]=4 681 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=C1 CS17661 [0,1,0,0,0,0|3,0,0]=4 682 B12R1.367 COC(=O)C1=CN=C(Cl)C(F)=C1 MC429992 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.367 COC(=O)C1=CN=C(Cl)C(O)=C1 CS17660 [0,1,0,0,0,0|2,0,0]=3 684 B12R1.367 COC(=O)C1=CN=C(N)C(C)=C1 MC431245 [0,1,0,0,0,0|3,0,0]=4 685 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 CS11621 [0,1,0,0,0,0|2,0,1]=4 686 B12R1.367 COC(=O)C1=NC(Br)=C(C)C=C1 CS19533 [0,1,0,0,0,0|3,0,0]=4 687 B12R1.367 COC(=O)C1=NC(C)=C(Br)C=C1 CS16719 [0,1,0,0,0,0|3,0,0]=4 688 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 CS16862 [0,1,0,0,0,0|3,0,0]=4 689 B12R1.367 COC(=O)C1=NC(Cl)=C(C)C=C1 CS16029 [0,1,0,0,0,0|3,0,0]=4 690 B12R1.367 COC(=O)C1=NC(Cl)=C(Cl)C=C1 CS16003 [0,1,0,0,0,0|3,0,0]=4 691 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 MC430945 [0,1,0,0,0,0|3,0,0]=4 692 B12R1.367 COC(=O)C1=NC(N)=C(N)C=C1 MC112955 [0,1,0,0,0,0|3,0,0]=4 693 B12R1.367 COC(=O)C1=NC(O)=C(C)C=C1 MC428183 [0,1,0,0,0,0|2,0,0]=3 694 B12R1.367 COC(=O)C1=NC(O)=C(O)C=C1 MC102411 [0,1,0,0,0,0|1,0,0]=2 695 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 CS17574 [0,1,0,0,0,0|3,0,0]=4 696 B12R1.367 COC(=O)C1=NC=C(C)C(Br)=C1 MC432006 [0,1,0,0,0,0|3,0,0]=4 697 B12R1.367 COC(=O)C1=NC=C(C)C(Cl)=C1 CS16028 [0,1,0,0,0,0|3,0,0]=4 698 B12R1.367 COC(=O)C1=NC=C(Cl)C(Cl)=C1 CS17982 [0,1,0,0,0,0|3,0,0]=4 699 B12R1.367 COC(=O)C1=NC=C(N)C(N)=C1 CS16611 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 MC102001 [0,1,0,0,0,0|1,0,0]=2 701 B12R1.367 NCC(=O)C1=CC(F)=C(Br)C=C1 MC114806 [0,1,0,0,0,0|3,0,0]=4 702 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 MC41226 [0,1,0,0,0,0|3,0,0]=4 703 B12R1.367 O=C(CBr)C1=CC(F)=C(Br)C=C1 MC114804 [0,1,0,0,0,0|3,0,0]=4 704 B12R1.367 O=C(CBr)C1=CC(F)=C(F)C=C1 CS20625 [0,1,0,0,0,0|3,0,0]=4 705 B12R1.367 O=C(CCl)C1=CC(F)=C(Br)C=C1 MC114805 [0,1,0,0,0,0|3,0,0]=4 706 B12R1.367 O=C(CCl)c1ccc(F)c(F)c1 MC433220 [0,1,0,0,0,0|3,0,0]=4 707 B12R1.893 CC(=O)C1=C(Br)C(F)=C(Br)C=C1 MC108788 [0,1,0,0,0,0|3,0,0]=4 708 B12R1.893 CC(=O)C1=C(C)C(F)=C(F)C=C1 MC110191 [0,1,0,0,0,0|3,0,0]=4 709 B12R1.893 CC(=O)C1=C(F)C(Br)=C(Br)C=C1 MC108795 [0,1,0,0,0,0|3,0,0]=4 710 B12R1.893 CC(=O)C1=C(F)C(Br)=C(F)C=C1 CS16567 [0,1,0,0,0,0|3,0,0]=4 711 B12R1.893 CC(=O)C1=C(F)C(Cl)=C(Cl)C=C1 MC109584 [0,1,0,0,0,0|3,0,0]=4 712 B12R1.893 CC(=O)C1=C(F)C(F)=C(F)C=C1 MC30125 [0,1,0,0,0,0|3,0,0]=4 713 B12R1.893 CC1=C(C(=O)O)C=CC(F)=C1F MC31065 [0,1,0,0,0,0|2,0,0]=3 714 B12R1.893 CC1=C(C(N)=O)C=CC(F)=C1F MC110206 [0,1,0,0,0,0|3,0,0]=4 715 B12R1.893 CC1=C(C)C(N)=C(C(=O)O)C=C1 CS14576 [0,1,0,0,0,0|2,0,0]=3 716 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1Cl CS12720 [0,1,0,0,0,0|2,0,0]=3 717 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1F CS19820 [0,1,0,0,0,0|2,0,0]=3 718 B12R1.893 CC1=C(N)C=CC(C(=O)O)=C1C MC30138 [0,1,0,0,0,0|2,0,0]=3 719 B12R1.893 CC1=C(O)C(Cl)=C([N+](=O)[O-])C=C1 CS10417 [0,1,0,0,0,0|2,0,1]=4 720 B12R1.893 CC1=C(O)C=CC([N+](=O)[O-])=C1C CS21007 [0,1,0,0,0,0|2,0,1]=4 721 B12R1.893 NC(=O)C1=C(Br)C(Br)=C(F)C=C1 MC108817 [0,1,0,0,0,0|3,0,0]=4 722 B12R1.893 NC(=O)C1=C(Br)C(F)=C(Br)C=C1 MC108820 [0,1,0,0,0,0|3,0,0]=4 723 B12R1.893 NC(=O)C1=C(Br)C(F)=C(F)C=C1 MC108396 [0,1,0,0,0,0|3,0,0]=4 724 B12R1.893 NC(=O)C1=C(Cl)C(F)=C(Cl)C=C1 MC109600 [0,1,0,0,0,0|3,0,0]=4 725 B12R1.893 NC(=O)C1=C(F)C(Br)=C(Br)C=C1 MC108824 [0,1,0,0,0,0|3,0,0]=4 726 B12R1.893 NC(=O)C1=C(F)C(Cl)=C(Cl)C=C1 MC109603 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.893 NC(=O)C1=C(F)C(F)=C(Br)C=C1 MC108401 [0,1,0,0,0,0|3,0,0]=4 728 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1Cl CS21226 [0,1,0,0,0,0|2,0,0]=3 729 B12R1.893 NC1=C(C(=O)O)C=CC(F)=C1F MC30133 [0,1,0,0,0,0|2,0,0]=3 730 B12R1.893 NC1=C(F)C(F)=C(C(=O)O)C=C1 MC433572 [0,1,0,0,0,0|2,0,0]=3 731 B12R1.893 O=C(Cl)C1=C(Br)C(Br)=C(F)C=C1 MC108898 [0,1,0,0,0,0|3,0,0]=4 732 B12R1.893 O=C(Cl)C1=C(Br)C(F)=C(Br)C=C1 MC108901 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.893 O=C(Cl)C1=C(Br)C(F)=C(F)C=C1 MC108430 [0,1,0,0,0,0|3,0,0]=4 734 B12R1.893 O=C(Cl)C1=C(F)C(Br)=C(Br)C=C1 MC108907 [0,1,0,0,0,0|3,0,0]=4 735 B12R1.893 O=C(Cl)C1=C(F)C(Cl)=C(Cl)C=C1 MC109660 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.893 O=C(Cl)C1=C(F)C(F)=C(F)C=C1 MC430032 [0,1,0,0,0,0|3,0,0]=4 737 B12R1.893 O=C(O)C1=C(Br)C(Br)=C(F)C=C1 MC108858 [0,1,0,0,0,0|2,0,0]=3 738 B12R1.893 O=C(O)C1=C(Br)C(F)=C(Br)C=C1 MC108860 [0,1,0,0,0,0|2,0,0]=3 739 B12R1.893 O=C(O)C1=C(Br)C(F)=C(F)C=C1 CS12732 [0,1,0,0,0,0|2,0,0]=3 740 B12R1.893 O=C(O)C1=C(Br)C(O)=C(Br)C=C1 MC442960 [0,1,0,0,0,0|1,0,0]=2 741 B12R1.893 O=C(O)C1=C(Cl)C(Br)=C(Cl)C=C1 CS17192 [0,1,0,0,0,0|2,0,0]=3 742 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(F)C=C1 CS21013 [0,1,0,0,0,0|2,0,0]=3 743 B12R1.893 O=C(O)C1=C(Cl)C(O)=C(Br)C=C1 MC442961 [0,1,0,0,0,0|1,0,0]=2 744 B12R1.893 O=C(O)C1=C(F)C(Br)=C(Br)C=C1 MC108862 [0,1,0,0,0,0|2,0,0]=3 745 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(F)C=C1 MC40249 [0,1,0,0,0,0|2,0,0]=3 746 B12R1.893 O=C(O)C1=C(F)C(F)=C(Br)C=C1 MC20269 [0,1,0,0,0,0|2,0,0]=3 747 B12R1.893 O=C(O)C1=C(F)C(F)=C(Cl)C=C1 CS22731 [0,1,0,0,0,0|2,0,0]=3 748 B12R1.893 O=C(O)C1=C(F)C(F)=C(F)C=C1 MC30124 [0,1,0,0,0,0|2,0,0]=3 749 B12R1.893 O=C(O)C1=C(F)C(F)=C(O)C=C1 MC40268 [0,1,0,0,0,0|1,0,0]=2 750 B12R1.893 O=C(O)C1=C(F)C(O)=C(F)C=C1 MC20265 [0,1,0,0,0,0|1,0,0]=2 751 B12R1.893 O=C(O)C1=C(O)C(F)=C(F)C=C1 MC40271 [0,1,0,0,0,0|2,0,0]=3 752 B12R1.893 O=C(O)C1=C(O)C(O)=C(Br)C=C1 MC442962 [0,1,0,0,0,0|1,0,0]=2 753 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl CS22766 [0,1,0,0,0,0|3,0,0]=4 754 B12R1.893 O=C(O)C1=NC=C(Br)C(Cl)=C1Br MC115180 [0,1,0,0,0,0|3,0,0]=4 755 B12R1.893 O=C(O)C1=NC=C(Cl)C(Cl)=C1Cl MC427419 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.893 O=C([O-])C1=C(F)C(Cl)=C(F)C=C1 MC40339 [0,1,0,0,0,0|2,0,1]=4 757 B12R1.893 O=C([O-])C1=C(F)C(F)=C(F)C=C1 MC40354 [0,1,0,0,0,0|2,0,1]=4 758 B12R1.893 O=[N+]([O-])C1=C(F)C(F)=C(O)C=C1 CS16565 [0,1,0,0,0,0|2,0,1]=4 759 B12R1.893 O=[N+]([O-])C1=CC=C(Br)C(O)=C1Br MC442965 [0,1,0,0,0,0|2,0,1]=4 760 B12R1.893 OB(O)C1=C(F)C(F)=C(O)C=C1 MC20501 [0,1,0,0,0,0|2,0,1]=4 761 B12R1.1005 CC(=O)C1=CC(Br)=C(Br)C(F)=C1 MC108796 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.1005 CC(=O)C1=CC(Br)=C(F)C(F)=C1 MC108395 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.1005 CC(=O)C1=CC(Cl)=C(Cl)C(C)=C1 MC109833 [0,1,0,0,0,0|3,0,0]=4 764 B12R1.1005 CC(=O)C1=CC(Cl)=C(Cl)C(F)=C1 MC109585 [0,1,0,0,0,0|3,0,0]=4 765 B12R1.1005 CC(=O)C1=CC(Cl)=C(N)C(Cl)=C1 CS20820 [0,1,0,0,0,0|3,0,0]=4 766 B12R1.1005 CC(=O)C1=CC(F)=C(F)C(C)=C1 MC110192 [0,1,0,0,0,0|3,0,0]=4 767 B12R1.1005 CC(=O)C1=CC(F)=C(F)C(F)=C1 CS10694 [0,1,0,0,0,0|3,0,0]=4 768 B12R1.1005 CC(=O)c1cc(Br)c(O)c(Br)c1 MC433230 [0,1,0,0,0,0|2,0,0]=3 769 B12R1.1005 CC1=C(Cl)C=C(C(=O)Cl)C=C1Cl MC40464 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1Cl CS14273 [0,1,0,0,0,0|2,0,0]=3 771 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1I MC425101 [0,1,0,0,0,0|2,0,0]=3 772 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1O CS12744 [0,1,0,0,0,0|1,0,0]=2 773 B12R1.1005 CC1=C(F)C=C(C(N)=O)C=C1F MC110208 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.1005 CC1=C(N)C=C(C(=O)O)C=C1F MC433581 [0,1,0,0,0,0|2,0,0]=3 775 B12R1.1005 CC1=C(N)C=C(C(=O)O)C=C1N MC40264 [0,1,0,0,0,0|2,0,0]=3 776 B12R1.1005 CC1=CC(C(=O)Cl)=CC(Cl)=C1Cl MC109872 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.1005 CC1=CC(C(=O)Cl)=CC(F)=C1F MC110261 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br MC433601 [0,1,0,0,0,0|2,0,0]=3 779 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1N CS14704 [0,1,0,0,0,0|2,0,0]=3 780 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1Br MC106554 [0,1,0,0,0,0|3,0,0]=4 781 B12R1.1005 CC1=CC(C(N)=O)=CC(Cl)=C1Cl MC109840 [0,1,0,0,0,0|3,0,0]=4 782 B12R1.1005 CC1=CC(C(N)=O)=CC(F)=C1F MC110207 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(C)=C1O MC41187 [0,1,0,0,0,0|2,0,1]=4 784 B12R1.1005 NC(=O)C1=CC(Br)=C(Br)C(F)=C1 MC108825 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.1005 NC(=O)C1=CC(Cl)=C(Cl)C(F)=C1 MC109604 [0,1,0,0,0,0|3,0,0]=4 786 B12R1.1005 NC(=O)C1=CC(Cl)=C(F)C(Cl)=C1 MC109605 [0,1,0,0,0,0|3,0,0]=4 787 B12R1.1005 NC1=C(Br)C=C(C(=O)O)C=C1Br CS20067 [0,1,0,0,0,0|2,0,0]=3 788 B12R1.1005 NC1=C(Br)C=C(C(=O)O)C=C1F CS17397 [0,1,0,0,0,0|2,0,0]=3 789 B12R1.1005 NC1=C(Cl)C(Cl)=CC(C(=O)O)=C1 MC20816 [0,1,0,0,0,0|2,0,0]=3 790 B12R1.1005 NC1=C(Cl)C=C(C(=O)O)C=C1Cl MC433569 [0,1,0,0,0,0|2,0,0]=3 791 B12R1.1005 NC1=C(F)C=C(C(=O)O)C=C1F MC433573 [0,1,0,0,0,0|2,0,0]=3 792 B12R1.1005 O=C(Cl)C1=CC(Br)=C(Br)C(F)=C1 MC108908 [0,1,0,0,0,0|3,0,0]=4 793 B12R1.1005 O=C(Cl)C1=CC(Br)=C(Cl)C(F)=C1 MC107948 [0,1,0,0,0,0|3,0,0]=4 794 B12R1.1005 O=C(Cl)C1=CC(Br)=C(F)C(Cl)=C1 MC107950 [0,1,0,0,0,0|3,0,0]=4 795 B12R1.1005 O=C(Cl)C1=CC(Br)=C(F)C(F)=C1 MC108433 [0,1,0,0,0,0|3,0,0]=4 796 B12R1.1005 O=C(Cl)C1=CC(Cl)=C(Br)C(F)=C1 MC107952 [0,1,0,0,0,0|3,0,0]=4 797 B12R1.1005 O=C(Cl)C1=CC(Cl)=C(Cl)C(F)=C1 MC109661 [0,1,0,0,0,0|3,0,0]=4 798 B12R1.1005 O=C(Cl)C1=CC(F)=C(Br)C(F)=C1 MC108434 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.1005 O=C(O)C1=CC(Br)=C(F)C(F)=C1 MC433597 [0,1,0,0,0,0|2,0,0]=3 800 B12R1.1005 O=C(O)C1=CC(Br)=C(O)C(Br)=C1 CS14160 [0,1,0,0,0,0|1,0,0]=2 801 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 CS12584 [0,1,0,0,0,0|2,0,0]=3 802 B12R1.1005 O=C(O)C1=CC(Cl)=C(F)C(Cl)=C1 MC30110 [0,1,0,0,0,0|2,0,0]=3 803 B12R1.1005 O=C(O)C1=CC(Cl)=C(F)C(F)=C1 MC433620 [0,1,0,0,0,0|2,0,0]=3 804 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(O)=C1 MC443792 [0,1,0,0,0,0|0,0,0]=1 805 B12R1.1005 O=C(O)C1=CC(F)=C(Br)C(F)=C1 CS16587 [0,1,0,0,0,0|2,0,0]=3 806 B12R1.1005 O=C(O)C1=CC(F)=C(Cl)C(F)=C1 MC40250 [0,1,0,0,0,0|2,0,0]=3 807 B12R1.1005 O=C(O)C1=CC(F)=C(F)C(F)=C1 MC30091 [0,1,0,0,0,0|2,0,0]=3 808 B12R1.1005 O=C(O)C1=CC(F)=C(O)C(F)=C1 MC40272 [0,1,0,0,0,0|1,0,0]=2 809 B12R1.1005 O=C(O)C1=CC(F)=C(O)C(F)=C1 MC442375 [0,1,0,0,0,0|1,0,0]=2 810 B12R1.1005 O=C(O)C1=CC(O)=C(Br)C(O)=C1 MC40237 [0,1,0,0,0,0|1,0,0]=2 811 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 MC427033 [0,1,0,0,0,0|0,0,0]=1 812 B12R1.1005 O=[N+]([O-])C1=CC(Br)=C(O)C(Br)=C1 MC41177 [0,1,0,0,0,0|2,0,1]=4 813 B12R1.1005 O=[N+]([O-])C1=CC(Br)=C(O)C(F)=C1 MC30235 [0,1,0,0,0,0|2,0,1]=4 814 B12R1.1005 O=[N+]([O-])C1=CC(F)=C(O)C(F)=C1 CS15529 [0,1,0,0,0,0|2,0,1]=4 815 B12R1.1005 O=[N+]([O-])C1=CC(O)=C(Br)C(F)=C1 MC20797 [0,1,0,0,0,0|2,0,1]=4 816 B12R1.1005 O=[N+]([O-])C1=CC(O)=C(F)C(F)=C1 CS17438 [0,1,0,0,0,0|2,0,1]=4 817 B12R1.1005 OB(O)C1=CC(Cl)=C(O)C(F)=C1 MC441704 [0,1,0,0,0,0|2,0,1]=4 818 B12R1.1005 OB(O)C1=CC(F)=C(F)C(O)=C1 MC103252 [0,1,0,0,0,0|2,0,1]=4 819 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 CS15301 [0,0,0,0,1,0|3,0,0]=4 820 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 CS21776 [0,0,0,0,1,0|3,0,0]=4 821 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 CS17233 [0,0,0,0,1,0|3,0,0]=4 822 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)S1 CS22495 [0,0,0,0,1,0|3,0,0]=4 823 B10R1.194 CC1=C(C(=O)O)SC=C1Br MC21121 [0,0,0,0,1,0|3,0,0]=4 824 B10R1.194 CC1=CNC(C(=O)O)=C1C CS16854 [0,0,0,0,1,0|3,0,0]=4 825 B10R1.194 CC1=CSC(C(=O)O)=C1N CS22070 [0,0,0,0,1,0|3,0,0]=4 826 B10R1.194 CC1=NNC(C(=O)O)=C1O MC106331 [0,0,0,0,1,0|3,0,0]=4 827 B10R1.194 CN1C(Br)=CC=C1C(=O)O CS12581 [0,0,0,0,1,0|3,0,0]=4 828 B10R1.194 O=C(O)C1=C(F)C(F)=CN1 MC104432 [0,0,0,0,1,0|3,0,0]=4 829 B12R1.19 CC(=O)Nc1ccc(C)c(C)c1 MC40962 [0,0,0,0,0,1|3,0,0]=4 830 B12R1.19 CC(=O)Nc1ccc(F)c(F)c1 MC40961 [0,0,0,0,0,1|3,0,0]=4 831 B12R1.19 CC(=O)OC1=CC(C)=C(Cl)C=C1 MC40003 [0,0,0,0,0,1|3,0,0]=4 832 B12R1.19 CC1=C(Br)C=CC(CC(=O)O)=C1 MC40151 [0,0,0,0,0,1|2,0,0]=3 833 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 MC21107 [0,0,0,0,0,1|2,0,0]=3 834 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 MC433950 [0,0,0,0,0,1|2,0,0]=3 835 B12R1.19 CC1=C(F)C=CC([ClH]C(=O)[O-])=C1 MC30266 [0,0,0,0,0,1|2,0,1]=4 836 B12R1.19 NC(=O)NC1=CC(Cl)=C(Cl)C=C1 CS20402 [0,0,0,0,0,1|3,0,0]=4 837 B12R1.19 O=C(O)CC1=CC(Br)=C(F)C=C1 CS18834 [0,0,0,0,0,1|2,0,0]=3 838 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 MC40146 [0,0,0,0,0,1|1,0,0]=2 839 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 CS20693 [0,0,0,0,0,1|2,0,0]=3 840 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 CS10724 [0,0,0,0,0,1|2,0,0]=3 841 B12R1.19 O=C(O)CC1=CC(F)=C(Br)C=C1 CS12651 [0,0,0,0,0,1|2,0,0]=3 842 B12R1.19 O=C(O)CC1=CC(F)=C(Cl)C=C1 CS22756 [0,0,0,0,0,1|2,0,0]=3 843 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 MC40163 [0,0,0,0,0,1|2,0,0]=3 844 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 MC40167 [0,0,0,0,0,1|1,0,0]=2 845 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 CS20953 [0,0,0,0,0,1|0,0,0]=1 846 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [2,0,0,0,0,0|2,0,0]=4 847 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [2,0,0,0,0,0|2,0,0]=4 848 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [2,0,0,0,0,0|1,0,0]=3 849 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [2,0,0,0,0,0|1,0,1]=4 850 B9R1.1 CC1=CN=C(C=O)C=C1 CS19088 [2,0,0,0,0,0|2,0,0]=4 851 B9R1.1 CC1=NC=C(C=O)C=C1 CS19116 [2,0,0,0,0,0|2,0,0]=4 852 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [2,0,0,0,0,0|1,0,1]=4 853 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [2,0,0,0,0,0|2,0,0]=4 854 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [2,0,0,0,0,0|2,0,0]=4 855 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [2,0,0,0,0,0|1,0,1]=4 856 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [2,0,0,0,0,0|1,0,0]=3 857 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [2,0,0,0,0,0|1,0,1]=4 858 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [2,0,0,0,0,0|1,0,1]=4 859 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [2,0,0,0,0,0|1,0,0]=3 860 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [2,0,0,0,0,0|1,0,0]=3 861 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [2,0,0,0,0,0|1,0,0]=3 862 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [2,0,0,0,0,0|1,0,0]=3 863 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [2,0,0,0,0,0|0,0,0]=2 864 B9R1.1 O=CC1=CN=C(Br)C=C1 CS13736 [2,0,0,0,0,0|2,0,0]=4 865 B9R1.1 O=CC1=CN=C(Cl)C=C1 CS13978 [2,0,0,0,0,0|2,0,0]=4 866 B9R1.1 O=CC1=CN=C(F)C=C1 CS19261 [2,0,0,0,0,0|2,0,0]=4 867 B9R1.1 O=CC1=CN=C(O)C=C1 CS13494 [2,0,0,0,0,0|1,0,0]=3 868 B9R1.1 O=CC1=NC=C(Br)C=C1 CS14127 [2,0,0,0,0,0|2,0,0]=4 869 B9R1.1 O=CC1=NC=C(Cl)C=C1 CS18956 [2,0,0,0,0,0|2,0,0]=4 870 B9R1.1 O=CC1=NC=C(F)C=C1 CS20057 [2,0,0,0,0,0|2,0,0]=4 871 B9R1.1 O=CC1=NC=C(O)C=C1 CS12167 [2,0,0,0,0,0|1,0,0]=3 872 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [2,0,0,0,0,0|1,0,1]=4 873 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [2,0,0,0,0,0|1,0,1]=4 874 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [2,0,0,0,0,0|1,0,1]=4 875 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [2,0,0,0,0,0|0,0,1]=3 876 B9R1.6 C=C(F)C1=CC=CC=C1 MC102770 [2,0,0,0,0,0|2,0,0]=4 877 B9R1.6 CC(=O)C1=CC=CC=C1 MC41221 [2,0,0,0,0,0|1,0,0]=3 878 B9R1.6 CC(=O)C1=CC=CN=C1 CS18256 [2,0,0,0,0,0|2,0,0]=4 879 B9R1.6 CC(=O)C1=CC=NC=C1 CS22535 [2,0,0,0,0,0|2,0,0]=4 880 B9R1.6 CC(=O)C1=NC=CC=C1 CS18611 [2,0,0,0,0,0|2,0,0]=4 881 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [2,0,0,0,0,0|1,0,1]=4 882 B9R1.6 C[PH](=O)C1=CC=CC=C1 CS16386 [2,0,0,0,0,0|2,0,0]=4 883 B9R1.6 N=C(N)C1=CC=CC=C1 CS14830 [2,0,0,0,0,0|2,0,0]=4 884 B9R1.6 NC(=O)C1=CC=CC=C1 CS10962 [2,0,0,0,0,0|1,0,0]=3 885 B9R1.6 NC(=O)C1=CC=NC=C1 CS13721 [2,0,0,0,0,0|2,0,0]=4 886 B9R1.6 NC(=O)C1=NC=CC=C1 CS11910 [2,0,0,0,0,0|2,0,0]=4 887 B9R1.6 NC(=S)C1=CC=CC=C1 MC20863 [2,0,0,0,0,0|1,1,0]=4 888 B9R1.6 O=C(Cl)C1=CC=CC=C1 MC40435 [2,0,0,0,0,0|1,0,0]=3 889 B9R1.6 O=C(Cl)C1=NC=CC=C1 CS11857 [2,0,0,0,0,0|2,0,0]=4 890 B9R1.6 O=C(O)C1=CC=CC=C1 MC40233 [2,0,0,0,0,0|0,0,0]=2 891 B9R1.6 O=C(O)C1=CC=CN=C1 MC41633 [2,0,0,0,0,0|1,0,0]=3 892 B9R1.6 O=C(O)C1=CC=CN=N1 CS19741 [2,0,0,0,0,0|2,0,0]=4 893 B9R1.6 O=C(O)C1=CN=CN=C1 CS17525 [2,0,0,0,0,0|2,0,0]=4 894 B9R1.6 O=C(O)C1=CN=NC=C1 MC41706 [2,0,0,0,0,0|2,0,0]=4 895 B9R1.6 O=C(O)C1=NC=CC=C1 CS13384 [2,0,0,0,0,0|1,0,0]=3 896 B9R1.6 O=C(O)C1=NC=CC=N1 CS18229 [2,0,0,0,0,0|2,0,0]=4 897 B9R1.6 O=C(O)C1=NC=CN=C1 CS17531 [2,0,0,0,0,0|2,0,0]=4 898 B9R1.6 O=C(O)C1=NC=NC=C1 CS14129 [2,0,0,0,0,0|2,0,0]=4 899 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 MC41586 [2,0,0,0,0,0|1,0,1]=4 900 B9R1.6 OB(O)C1=CC=CC=C1 CS19450 [2,0,0,0,0,0|1,0,1]=4 901 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [2,0,0,0,0,0|1,0,1]=4 902 B9R1.2 CC1=CC(C=O)=CN=C1 MC425681 [2,0,0,0,0,0|2,0,0]=4 903 B9R1.2 CC1=CC(C=O)=NC=C1 CS19123 [2,0,0,0,0,0|2,0,0]=4 904 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [2,0,0,0,0,0|1,0,0]=3 905 B9R1.2 CC1=CC=CC(C=O)=N1 MC41626 [2,0,0,0,0,0|2,0,0]=4 906 B9R1.2 CC1=NC=CC(C=O)=C1 CS15441 [2,0,0,0,0,0|2,0,0]=4 907 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [2,0,0,0,0,0|2,0,0]=4 908 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [2,0,0,0,0,0|2,0,0]=4 909 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [2,0,0,0,0,0|1,0,1]=4 910 B9R1.2 NC1=CC=CC(C=O)=N1 MC110929 [2,0,0,0,0,0|2,0,0]=4 911 B9R1.2 NC1=CC=CC(CO)=C1 CS18821 [2,0,0,0,0,0|1,0,1]=4 912 B9R1.2 NC1=NC=CC(C=O)=C1 CS18505 [2,0,0,0,0,0|2,0,0]=4 913 B9R1.2 NC1=NC=CC(C=O)=C1 MC103369 [2,0,0,0,0,0|2,0,0]=4 914 B9R1.2 O=CC1=CC(Br)=CC=C1 CS18958 [2,0,0,0,0,0|1,0,0]=3 915 B9R1.2 O=CC1=CC(Br)=NC=C1 CS18783 [2,0,0,0,0,0|2,0,0]=4 916 B9R1.2 O=CC1=CC(Cl)=CC=C1 MC20579 [2,0,0,0,0,0|1,0,0]=3 917 B9R1.2 O=CC1=CC(F)=CC=C1 CS22298 [2,0,0,0,0,0|1,0,0]=3 918 B9R1.2 O=CC1=CC(F)=NC=C1 MC431324 [2,0,0,0,0,0|2,0,0]=4 919 B9R1.2 O=CC1=CC(I)=CC=C1 CS20132 [2,0,0,0,0,0|1,0,0]=3 920 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [2,0,0,0,0,0|0,0,0]=2 921 B9R1.2 O=CC1=CC=C[N+]([O-])=C1 CS17137 [2,0,0,0,0,0|1,0,1]=4 922 B9R1.2 O=CC1=CN=CC(Br)=C1 MC20791 [2,0,0,0,0,0|2,0,0]=4 923 B9R1.2 O=CC1=CN=CC(F)=C1 CS19040 [2,0,0,0,0,0|2,0,0]=4 924 B9R1.2 O=CC1=CN=CC(O)=C1 CS15599 [2,0,0,0,0,0|1,0,0]=3 925 B9R1.2 O=CC1=NC(Br)=CC=C1 CS22094 [2,0,0,0,0,0|2,0,0]=4 926 B9R1.2 O=CC1=NC(Cl)=CC=C1 CS19944 [2,0,0,0,0,0|2,0,0]=4 927 B9R1.2 O=CC1=NC(F)=CC=C1 CS13928 [2,0,0,0,0,0|2,0,0]=4 928 B9R1.2 O=CC1=NC=CC(Br)=C1 CS12092 [2,0,0,0,0,0|2,0,0]=4 929 B9R1.2 O=CC1=NC=CC(Cl)=C1 CS22794 [2,0,0,0,0,0|2,0,0]=4 930 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [2,0,0,0,0,0|1,0,1]=4 931 B9R1.2 OCC1=CC(F)=CC=C1 CS19069 [2,0,0,0,0,0|1,0,1]=4 932 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [2,0,0,0,0,0|0,0,1]=3 933 B9R1.2 OCC1=NC=CC(O)=C1 CS17612 [2,0,0,0,0,0|1,0,1]=4 934 B9R1.69 CC1=C(Br)C=C(O)C=C1 CS12184 [2,0,0,0,0,0|2,0,0]=4 935 B9R1.69 CC1=C(Br)C=CC(O)=C1 CS20279 [2,0,0,0,0,0|2,0,0]=4 936 B9R1.69 CC1=C(C)C=C(O)C=C1 MC41191 [2,0,0,0,0,0|2,0,0]=4 937 B9R1.69 CC1=C(Cl)C=C(O)C=C1 MC33172 [2,0,0,0,0,0|2,0,0]=4 938 B9R1.69 CC1=C(Cl)C=CC(O)=C1 MC41173 [2,0,0,0,0,0|2,0,0]=4 939 B9R1.69 CC1=C(F)C=C(O)C=C1 CS10481 [2,0,0,0,0,0|2,0,0]=4 940 B9R1.69 CC1=C(F)C=CC(O)=C1 CS10483 [2,0,0,0,0,0|2,0,0]=4 941 B9R1.69 CC1=C(I)C=CC(O)=C1 CS22901 [2,0,0,0,0,0|2,0,0]=4 942 B9R1.69 CC1=C(N)C=C(O)C=C1 MC30249 [2,0,0,0,0,0|2,0,0]=4 943 B9R1.69 CC1=C(N)C=CC(O)=C1 CS14087 [2,0,0,0,0,0|2,0,0]=4 944 B9R1.69 CC1=C(O)C=C(Br)C=C1 CS10275 [2,0,0,0,0,0|2,0,0]=4 945 B9R1.69 CC1=C(O)C=C(F)C=C1 CS10484 [2,0,0,0,0,0|2,0,0]=4 946 B9R1.69 CC1=C(O)C=C(N)C=C1 CS10536 [2,0,0,0,0,0|2,0,0]=4 947 B9R1.69 CC1=C(O)C=C(O)C=C1 CS20391 [2,0,0,0,0,0|1,0,0]=3 948 B9R1.69 CC1=C(O)C=CC(Br)=C1 MC20395 [2,0,0,0,0,0|2,0,0]=4 949 B9R1.69 CC1=C(O)C=CC(Cl)=C1 CS20290 [2,0,0,0,0,0|2,0,0]=4 950 B9R1.69 CC1=C(O)C=CC(F)=C1 CS10482 [2,0,0,0,0,0|2,0,0]=4 951 B9R1.69 CC1=C(O)C=CC(I)=C1 MC30013 [2,0,0,0,0,0|2,0,0]=4 952 B9R1.69 CC1=C(O)C=CC(N)=C1 MC30012 [2,0,0,0,0,0|2,0,0]=4 953 B9R1.69 CC1=CC(=O)C=CC1=O MC41219 [2,0,0,0,0,0|1,0,1]=4 954 B9R1.69 CC1=CC(C)=C(O)C=C1 MC30165 [2,0,0,0,0,0|1,0,1]=4 955 B9R1.69 CC1=CC(Cl)=C(O)C=C1 CS20292 [2,0,0,0,0,0|1,0,1]=4 956 B9R1.69 CC1=CC(I)=C(O)C=C1 MC41201 [2,0,0,0,0,0|1,0,1]=4 957 B9R1.69 CC1=CC(O)=C(Br)C=C1 CS16357 [2,0,0,0,0,0|1,0,1]=4 958 B9R1.69 CC1=CC(O)=C(C)C=C1 CS19431 [2,0,0,0,0,0|1,0,1]=4 959 B9R1.69 CC1=CC(O)=C(F)C=C1 MC41196 [2,0,0,0,0,0|1,0,1]=4 960 B9R1.69 CC1=CC(O)=C(N)C=C1 CS14086 [2,0,0,0,0,0|1,0,1]=4 961 B9R1.69 CC1=CC=C(O)C(O)=C1 CS14435 [2,0,0,0,0,0|0,0,1]=3 962 B9R1.69 NC1=C(Br)C=C(O)C=C1 MC41139 [2,0,0,0,0,0|2,0,0]=4 963 B9R1.69 NC1=C(Br)C=CC(O)=C1 CS14504 [2,0,0,0,0,0|2,0,0]=4 964 B9R1.69 NC1=C(Cl)C=C(O)C=C1 CS18805 [2,0,0,0,0,0|2,0,0]=4 965 B9R1.69 NC1=C(Cl)C=C(O)C=C1 MC10180 [2,0,0,0,0,0|2,0,0]=4 966 B9R1.69 NC1=C(F)C=C(O)C=C1 CS23017 [2,0,0,0,0,0|2,0,0]=4 967 B9R1.69 NC1=C(F)C=CC(O)=C1 CS19712 [2,0,0,0,0,0|2,0,0]=4 968 B9R1.69 NC1=C(F)C=CC(O)=C1 MC433346 [2,0,0,0,0,0|2,0,0]=4 969 B9R1.69 NC1=C(O)C=C(Br)C=C1 CS21272 [2,0,0,0,0,0|2,0,0]=4 970 B9R1.69 NC1=C(O)C=C(Cl)C=C1 CS19300 [2,0,0,0,0,0|2,0,0]=4 971 B9R1.69 NC1=C(O)C=C(F)C=C1 CS23016 [2,0,0,0,0,0|2,0,0]=4 972 B9R1.69 NC1=C(O)C=C(O)C=C1 CS22592 [2,0,0,0,0,0|1,0,0]=3 973 B9R1.69 NC1=C(O)C=CC(Br)=C1 CS14311 [2,0,0,0,0,0|2,0,0]=4 974 B9R1.69 NC1=C(O)C=CC(Cl)=C1 CS16374 [2,0,0,0,0,0|2,0,0]=4 975 B9R1.69 NC1=C(O)C=CC(F)=C1 MC20123 [2,0,0,0,0,0|2,0,0]=4 976 B9R1.69 NC1=CC(Br)=C(O)C=C1 MC30074 [2,0,0,0,0,0|2,0,0]=4 977 B9R1.69 NC1=CC(Cl)=C(O)C=C1 CS19309 [2,0,0,0,0,0|2,0,0]=4 978 B9R1.69 NC1=CC(F)=C(O)C=C1 MC30224 [2,0,0,0,0,0|2,0,0]=4 979 B9R1.69 NC1=CC(N)=C(O)C=C1 CS16325 [2,0,0,0,0,0|2,0,0]=4 980 B9R1.69 NC1=CC(O)=C(Cl)C=C1 MC433340 [2,0,0,0,0,0|2,0,0]=4 981 B9R1.69 NC1=CC(O)=C(F)C=C1 CS13999 [2,0,0,0,0,0|2,0,0]=4 982 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 CS15632 [2,0,0,0,0,0|2,0,0]=4 983 B9R1.69 OC1=C(Br)C=C(F)C=C1 MC10138 [2,0,0,0,0,0|2,0,0]=4 984 B9R1.69 OC1=C(Br)C=C(I)C=C1 MC441118 [2,0,0,0,0,0|2,0,0]=4 985 B9R1.69 OC1=C(Br)C=CC(Br)=C1 MC30180 [2,0,0,0,0,0|2,0,0]=4 986 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 CS21372 [2,0,0,0,0,0|2,0,0]=4 987 B9R1.69 OC1=C(Br)C=CC(F)=C1 MC20075 [2,0,0,0,0,0|2,0,0]=4 988 B9R1.69 OC1=C(Br)C=CC(I)=C1 CS13046 [2,0,0,0,0,0|2,0,0]=4 989 B9R1.69 OC1=C(Cl)C=C(Cl)C=C1 MC41180 [2,0,0,0,0,0|2,0,0]=4 990 B9R1.69 OC1=C(Cl)C=C(F)C=C1 CS13904 [2,0,0,0,0,0|2,0,0]=4 991 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 MC20037 [2,0,0,0,0,0|2,0,0]=4 992 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 CS21143 [2,0,0,0,0,0|2,0,0]=4 993 B9R1.69 OC1=C(Cl)C=CC(F)=C1 CS22918 [2,0,0,0,0,0|2,0,0]=4 994 B9R1.69 OC1=C(F)C=C(Br)C=C1 CS22908 [2,0,0,0,0,0|2,0,0]=4 995 B9R1.69 OC1=C(F)C=C(Cl)C=C1 MC41170 [2,0,0,0,0,0|2,0,0]=4 996 B9R1.69 OC1=C(F)C=C(F)C=C1 CS19015 [2,0,0,0,0,0|2,0,0]=4 997 B9R1.69 OC1=C(F)C=C(I)C=C1 MC433386 [2,0,0,0,0,0|2,0,0]=4 998 B9R1.69 OC1=C(F)C=CC(Br)=C1 CS22910 [2,0,0,0,0,0|2,0,0]=4 999 B9R1.69 OC1=C(F)C=CC(Cl)=C1 CS22920 [2,0,0,0,0,0|2,0,0]=4 1000 B9R1.69 OC1=C(F)C=CC(F)=C1 MC41184 [2,0,0,0,0,0|2,0,0]=4 1001 B9R1.69 OC1=C(F)C=CC(I)=C1 CS12536 [2,0,0,0,0,0|2,0,0]=4 1002 B9R1.69 OC1=C(I)C=C(Br)C=C1 MC433360 [2,0,0,0,0,0|2,0,0]=4 1003 B9R1.69 OC1=C(I)C=C(Cl)C=C1 CS22744 [2,0,0,0,0,0|2,0,0]=4 1004 B9R1.69 OC1=C(I)C=C(F)C=C1 CS13176 [2,0,0,0,0,0|2,0,0]=4 1005 B9R1.69 OC1=C(I)C=CC(Br)=C1 MC442822 [2,0,0,0,0,0|2,0,0]=4 1006 B9R1.69 OC1=C(I)C=CC(Cl)=C1 CS10328 [2,0,0,0,0,0|2,0,0]=4 1007 B9R1.69 OC1=C(I)C=CC(F)=C1 MC441216 [2,0,0,0,0,0|2,0,0]=4 1008 B9R1.69 OC1=C(I)C=CC(I)=C1 MC442225 [2,0,0,0,0,0|2,0,0]=4 1009 B9R1.69 OC1=CC(Br)=C(Br)C=C1 MC442091 [2,0,0,0,0,0|2,0,0]=4 1010 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 CS22149 [2,0,0,0,0,0|2,0,0]=4 1011 B9R1.69 OC1=CC(Br)=C(F)C=C1 CS22905 [2,0,0,0,0,0|2,0,0]=4 1012 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 MC20176 [2,0,0,0,0,0|2,0,0]=4 1013 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 MC41181 [2,0,0,0,0,0|2,0,0]=4 1014 B9R1.69 OC1=CC(Cl)=C(F)C=C1 MC33094 [2,0,0,0,0,0|2,0,0]=4 1015 B9R1.69 OC1=CC(Cl)=C(I)C=C1 MC30273 [2,0,0,0,0,0|2,0,0]=4 1016 B9R1.69 OC1=CC(F)=C(Br)C=C1 CS22909 [2,0,0,0,0,0|2,0,0]=4 1017 B9R1.69 OC1=CC(F)=C(Cl)C=C1 CS22919 [2,0,0,0,0,0|2,0,0]=4 1018 B9R1.69 OC1=CC(F)=C(F)C=C1 CS22926 [2,0,0,0,0,0|2,0,0]=4 1019 B9R1.69 OC1=CC(F)=C(I)C=C1 CS15852 [2,0,0,0,0,0|2,0,0]=4 1020 B9R1.69 OC1=CC(F)=C(O)C=C1 MC20784 [2,0,0,0,0,0|1,0,0]=3 1021 B9R1.69 OC1=CC(I)=C(Cl)C=C1 MC433368 [2,0,0,0,0,0|2,0,0]=4 1022 B9R1.69 OC1=CC(I)=C(F)C=C1 MC442383 [2,0,0,0,0,0|2,0,0]=4 1023 B9R1.69 OC1=CC(O)=C(Br)C=C1 CS22703 [2,0,0,0,0,0|1,0,0]=3 1024 B9R1.69 OC1=CC(O)=C(F)C=C1 CS22989 [2,0,0,0,0,0|1,0,0]=3 1025 B9R1.69 OC1=CC=C(Br)C=C1O CS22676 [2,0,0,0,0,0|1,0,0]=3 1026 B9R1.69 OC1=NC(Cl)=C(O)C=C1 MC432030 [2,0,0,0,0,0|2,0,0]=4 1027 B11R1.3 C#Cc1ccc(C(=O)O)cc1 CS17809 [1,1,0,0,0,0|1,0,0]=3 1028 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 MC20903 [1,1,0,0,0,0|2,0,0]=4 1029 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 MC425378 [1,1,0,0,0,0|1,0,0]=3 1030 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 CS18730 [1,1,0,0,0,0|2,0,0]=4 1031 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 CS12193 [1,1,0,0,0,0|2,0,0]=4 1032 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CS13406 [1,1,0,0,0,0|1,0,0]=3 1033 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 MC441036 [1,1,0,0,0,0|2,0,0]=4 1034 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 MC20232 [1,1,0,0,0,0|1,0,0]=3 1035 B11R1.3 COC1=CC=C(B(O)O)C=C1 CS10530 [1,1,0,0,0,0|1,0,1]=4 1036 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 MC20515 [1,1,0,0,0,0|1,0,0]=3 1037 B11R1.3 COC1=CC=C(C(C)=O)C=C1 MC41262 [1,1,0,0,0,0|1,0,0]=3 1038 B11R1.3 COC1=CC=C(C(C)=O)C=N1 CS20044 [1,1,0,0,0,0|2,0,0]=4 1039 B11R1.3 COC1=CN=C(C(=O)O)C=C1 CS18937 [1,1,0,0,0,0|1,0,0]=3 1040 B11R1.3 COC1=CN=C(C(=O)O)C=N1 CS12309 [1,1,0,0,0,0|2,0,0]=4 1041 B11R1.3 COC1=CN=C(C(C)=O)C=C1 MC105069 [1,1,0,0,0,0|2,0,0]=4 1042 B11R1.3 COC1=NC=C(C(=O)O)C=C1 CS10490 [1,1,0,0,0,0|1,0,0]=3 1043 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 MC40462 [1,1,0,0,0,0|2,0,0]=4 1044 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 CS21997 [1,1,0,0,0,0|1,0,0]=3 1045 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 CS15778 [1,1,0,0,0,0|2,0,0]=4 1046 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 MC20325 [1,1,0,0,0,0|1,0,0]=3 1047 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CS10519 [1,1,0,0,0,0|1,0,0]=3 1048 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 CS14658 [1,1,0,0,0,0|1,0,1]=4 1049 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 MC40458 [1,1,0,0,0,0|2,0,0]=4 1050 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 MC10316 [1,1,0,0,0,0|1,0,0]=3 1051 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 CS20829 [1,1,0,0,0,0|1,0,0]=3 1052 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 CS20945 [1,1,0,0,0,0|0,0,0]=2 1053 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 MC115965 [1,1,0,0,0,0|1,0,0]=3 1054 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 CS20792 [1,1,0,0,0,0|0,0,1]=3 1055 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 CS19205 [1,1,0,0,0,0|1,0,1]=4 1056 B11R1.3 OCC1=CC=C(B(O)O)C=C1 CS20400 [1,1,0,0,0,0|1,0,1]=4 1057 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS12653 [1,1,0,0,0,0|2,0,0]=4 1058 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC102832 [1,1,0,0,0,0|2,0,0]=4 1059 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC107660 [1,1,0,0,0,0|2,0,0]=4 1060 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC111069 [1,1,0,0,0,0|2,0,0]=4 1061 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC111070 [1,1,0,0,0,0|2,0,0]=4 1062 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC114003 [1,1,0,0,0,0|2,0,0]=4 1063 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC115790 [1,1,0,0,0,0|2,0,0]=4 1064 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC20639 [1,1,0,0,0,0|2,0,0]=4 1065 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC20805 [1,1,0,0,0,0|2,0,0]=4 1066 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC33259 [1,1,0,0,0,0|2,0,0]=4 1067 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC425317 [1,1,0,0,0,0|2,0,0]=4 1068 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC425323 [1,1,0,0,0,0|2,0,0]=4 1069 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 CS20393 [1,1,0,0,0,0|1,0,1]=4 1070 B11R1.19 Cc1ccc(S(=O)(=O)O)cc1 MC436139 [1,1,0,0,0,0|2,0,0]=4 1071 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 CS18679 [1,1,0,0,0,0|2,0,0]=4 1072 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 CS19082 [1,1,0,0,0,0|2,0,0]=4 1073 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS22698 [1,1,0,0,0,0|2,0,0]=4 1074 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS22795 [1,1,0,0,0,0|2,0,0]=4 1075 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS22846 [1,1,0,0,0,0|2,0,0]=4 1076 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 CS15690 [1,1,0,0,0,0|1,0,0]=3 1077 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 CS15303 [1,1,0,0,0,0|1,0,0]=3 1078 B11R1.22 COC(=O)C1=CC=C(C)C=C1 MC40114 [1,1,0,0,0,0|1,0,0]=3 1079 B11R1.22 COC(=O)C1=CC=C(F)C=C1 CS20841 [1,1,0,0,0,0|1,0,0]=3 1080 B11R1.22 COC(=O)C1=CC=C(I)C=C1 CS20853 [1,1,0,0,0,0|1,0,0]=3 1081 B11R1.22 COC(=O)C1=CC=C(N)C=C1 CS20990 [1,1,0,0,0,0|1,0,0]=3 1082 B11R1.22 COC(=O)C1=CC=C(O)C=C1 CS19446 [1,1,0,0,0,0|0,0,0]=2 1083 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 CS14052 [1,1,0,0,0,0|2,0,0]=4 1084 B11R1.22 COC(=O)C1=CN=C(C)C=C1 CS10875 [1,1,0,0,0,0|2,0,0]=4 1085 B11R1.22 COC(=O)C1=CN=C(F)C=C1 CS13697 [1,1,0,0,0,0|2,0,0]=4 1086 B11R1.22 COC(=O)C1=CN=C(N)C=C1 CS14193 [1,1,0,0,0,0|2,0,0]=4 1087 B11R1.22 COC(=O)C1=CN=C(O)C=C1 CS19248 [1,1,0,0,0,0|1,0,0]=3 1088 B11R1.22 COC(=O)C1=COC(=O)C=C1 CS19181 [1,1,0,0,0,0|1,0,1]=4 1089 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 CS14099 [1,1,0,0,0,0|2,0,0]=4 1090 B11R1.22 COC(=O)C1=NC=C(C)C=C1 CS15553 [1,1,0,0,0,0|2,0,0]=4 1091 B11R1.22 COC(=O)C1=NC=C(F)C=C1 CS16224 [1,1,0,0,0,0|2,0,0]=4 1092 B11R1.22 COC(=O)C1=NC=C(N)C=C1 CS21755 [1,1,0,0,0,0|2,0,0]=4 1093 B11R1.22 COC(=O)C1=NC=C(O)C=C1 CS10406 [1,1,0,0,0,0|1,0,0]=3 1094 B11R1.22 COC(=O)C1=NC=C(O)N=C1 CS19747 [1,1,0,0,0,0|2,0,0]=4 1095 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS10839 [1,1,0,0,0,0|2,0,0]=4 1096 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS20894 [1,1,0,0,0,0|2,0,0]=4 1097 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 MC33165 [1,1,0,0,0,0|2,0,0]=4 1098 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 MC20179 [1,1,0,0,0,0|2,0,0]=4 1099 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 MC41002 [1,1,0,0,0,0|2,0,0]=4 1100 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 MC41004 [1,1,0,0,0,0|2,0,0]=4 1101 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 MC41003 [1,1,0,0,0,0|1,0,0]=3 1102 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 MC428196 [1,1,0,0,0,0|2,0,0]=4 1103 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 MC41822 [1,1,0,0,0,0|2,0,0]=4 1104 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 CS19445 [1,1,0,0,0,0|2,0,0]=4 1105 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 MC433210 [1,1,0,0,0,0|2,0,0]=4 1106 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS20678 [1,1,0,0,0,0|2,0,0]=4 1107 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS10771 [1,1,0,0,0,0|1,0,0]=3 1108 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 CS14324 [1,1,0,0,0,0|2,0,0]=4 1109 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 MC41236 [1,1,0,0,0,0|2,0,0]=4 1110 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 CS15989 [1,1,0,0,0,0|1,0,1]=4 1111 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 MC427408 [1,1,0,0,0,0|1,0,1]=4 1112 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 CS20192 [1,1,0,0,0,0|1,0,1]=4 1113 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS18120 [1,1,0,0,0,0|0,0,1]=3 1114 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 MC41228 [1,1,0,0,0,0|2,0,0]=4 1115 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 MC433202 [1,1,0,0,0,0|2,0,0]=4 1116 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 CS21355 [1,1,0,0,0,0|1,0,0]=3 1117 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 MC41255 [1,1,0,0,0,0|2,0,0]=4 1118 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 CS14036 [1,1,0,0,0,0|2,0,0]=4 1119 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 CS21093 [1,1,0,0,0,0|2,0,0]=4 1120 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 CS21444 [1,1,0,0,0,0|2,0,0]=4 1121 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 MC425453 [1,1,0,0,0,0|2,0,0]=4 1122 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 CS20824 [1,1,0,0,0,0|1,0,0]=3 1123 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 CS20682 [1,1,0,0,0,0|2,0,0]=4 1124 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 MC430999 [1,1,0,0,0,0|2,0,0]=4 1125 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 CS22739 [1,1,0,0,0,0|2,0,0]=4 1126 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 CS19013 [1,1,0,0,0,0|2,0,0]=4 1127 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 CS16419 [1,1,0,0,0,0|1,0,0]=3 1128 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 MC431781 [1,1,0,0,0,0|2,0,0]=4 1129 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 CS22645 [1,1,0,0,0,0|2,0,0]=4 1130 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 MC10406 [1,1,0,0,0,0|2,0,0]=4 1131 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 MC10405 [1,1,0,0,0,0|2,0,0]=4 1132 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 CS20409 [1,1,0,0,0,0|2,0,0]=4 1133 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 CS19678 [1,1,0,0,0,0|1,0,0]=3 1134 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 MC21132 [1,1,0,0,0,0|1,0,1]=4 1135 B11R1.166 CC1=C(C(=O)Cl)C=CC(F)=C1 MC40480 [1,1,0,0,0,0|2,0,0]=4 1136 B11R1.166 CC1=C(C(=O)O)C=CC(=O)O1 MC427282 [1,1,0,0,0,0|1,0,1]=4 1137 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 CS15606 [1,1,0,0,0,0|1,0,0]=3 1138 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 CS22749 [1,1,0,0,0,0|1,0,0]=3 1139 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 CS14724 [1,1,0,0,0,0|2,0,0]=4 1140 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 CS21999 [1,1,0,0,0,0|1,0,0]=3 1141 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 CS19398 [1,1,0,0,0,0|2,0,0]=4 1142 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 CS18188 [1,1,0,0,0,0|1,0,0]=3 1143 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 CS12971 [1,1,0,0,0,0|0,0,0]=2 1144 B11R1.166 CC1=CC(=O)C(C(=O)O)=CN1 CS12084 [1,1,0,0,0,0|2,0,0]=4 1145 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CS21362 [1,1,0,0,0,0|1,0,0]=3 1146 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O CS17552 [1,1,0,0,0,0|2,0,0]=4 1147 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O MC431042 [1,1,0,0,0,0|2,0,0]=4 1148 B11R1.166 CC1=CC(C)=C(C(=O)Cl)C=C1 MC40470 [1,1,0,0,0,0|2,0,0]=4 1149 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 CS21071 [1,1,0,0,0,0|1,0,0]=3 1150 B11R1.166 CC1=CC(C)=NC=C1C(=O)O CS22514 [1,1,0,0,0,0|2,0,0]=4 1151 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 CS21449 [1,1,0,0,0,0|1,0,0]=3 1152 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O CS17583 [1,1,0,0,0,0|2,0,0]=4 1153 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O MC425056 [1,1,0,0,0,0|2,0,0]=4 1154 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 CS20842 [1,1,0,0,0,0|1,0,0]=3 1155 B11R1.166 CC1=CC(F)=CN=C1C(=O)O MC431877 [1,1,0,0,0,0|2,0,0]=4 1156 B11R1.166 CC1=CC(F)=NC=C1C(=O)O MC432072 [1,1,0,0,0,0|2,0,0]=4 1157 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 CS13976 [1,1,0,0,0,0|1,0,0]=3 1158 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 CS20440 [1,1,0,0,0,0|2,0,0]=4 1159 B11R1.166 CC1=CC(N)=NC=C1C(=O)O MC427212 [1,1,0,0,0,0|2,0,0]=4 1160 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 CS20948 [1,1,0,0,0,0|1,0,0]=3 1161 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] CS20328 [1,1,0,0,0,0|1,0,1]=4 1162 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 CS15720 [1,1,0,0,0,0|2,0,0]=4 1163 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 MC103700 [1,1,0,0,0,0|2,0,0]=4 1164 B11R1.166 CC1=NC(Cl)=C(C(=O)O)C=C1 CS20205 [1,1,0,0,0,0|2,0,0]=4 1165 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 CS15914 [1,1,0,0,0,0|2,0,0]=4 1166 B11R1.166 CC1=NC=C(C(=O)O)C(F)=C1 MC432353 [1,1,0,0,0,0|2,0,0]=4 1167 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 CS12116 [1,1,0,0,0,0|2,0,0]=4 1168 B11R1.166 CC1=NC=C(C(=O)O)C(O)=C1 CS20333 [1,1,0,0,0,0|2,0,0]=4 1169 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 MC433800 [1,1,0,0,0,0|2,0,0]=4 1170 B11R1.166 NC(=O)C1=C(Br)C=C(F)C=C1 MC430721 [1,1,0,0,0,0|2,0,0]=4 1171 B11R1.166 NC(=O)C1=C(Br)C=C(I)C=C1 MC432630 [1,1,0,0,0,0|2,0,0]=4 1172 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 MC111276 [1,1,0,0,0,0|2,0,0]=4 1173 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 CS14625 [1,1,0,0,0,0|2,0,0]=4 1174 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 CS15300 [1,1,0,0,0,0|2,0,0]=4 1175 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 MC445681 [1,1,0,0,0,0|1,0,0]=3 1176 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 CS20180 [1,1,0,0,0,0|1,0,0]=3 1177 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 MC432153 [1,1,0,0,0,0|2,0,0]=4 1178 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 CS20207 [1,1,0,0,0,0|1,0,0]=3 1179 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 CS14921 [1,1,0,0,0,0|2,0,0]=4 1180 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 CS21809 [1,1,0,0,0,0|1,0,0]=3 1181 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 CS21253 [1,1,0,0,0,0|1,0,0]=3 1182 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 CS12851 [1,1,0,0,0,0|0,0,0]=2 1183 B11R1.166 NC1=C([N+](=O)[O-])C=CC(O)=C1 MC30063 [1,1,0,0,0,0|1,0,1]=4 1184 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O CS14395 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 CS10414 [1,1,0,0,0,0|1,0,0]=3 1186 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O MC429964 [1,1,0,0,0,0|2,0,0]=4 1187 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 CS20227 [1,1,0,0,0,0|1,0,0]=3 1188 B11R1.166 NC1=CC(F)=NC=C1C(=O)O MC103397 [1,1,0,0,0,0|2,0,0]=4 1189 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 CS22593 [1,1,0,0,0,0|1,0,0]=3 1190 B11R1.166 NC1=CC(O)=NC=C1C(=O)O CS22578 [1,1,0,0,0,0|1,0,0]=3 1191 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 MC40444 [1,1,0,0,0,0|2,0,0]=4 1192 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 MC40465 [1,1,0,0,0,0|2,0,0]=4 1193 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 CS21072 [1,1,0,0,0,0|1,0,0]=3 1194 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 CS19824 [1,1,0,0,0,0|1,0,0]=3 1195 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 CS21353 [1,1,0,0,0,0|1,0,0]=3 1196 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 CS15275 [1,1,0,0,0,0|1,0,0]=3 1197 B11R1.166 O=C(O)C1=C(Br)N=C(F)C=C1 MC431766 [1,1,0,0,0,0|2,0,0]=4 1198 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 CS10220 [1,1,0,0,0,0|1,0,0]=3 1199 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 CS14611 [1,1,0,0,0,0|1,0,0]=3 1200 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 MC40252 [1,1,0,0,0,0|1,0,0]=3 1201 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CS20109 [1,1,0,0,0,0|0,0,0]=2 1202 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 MC432617 [1,1,0,0,0,0|2,0,0]=4 1203 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 CS21796 [1,1,0,0,0,0|2,0,0]=4 1204 B11R1.166 O=C(O)C1=C(Cl)N=C(F)C=C1 MC431623 [1,1,0,0,0,0|2,0,0]=4 1205 B11R1.166 O=C(O)C1=C(Cl)N=C(O)C=C1 CS19029 [1,1,0,0,0,0|1,0,0]=3 1206 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 CS21987 [1,1,0,0,0,0|1,0,0]=3 1207 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 MC40253 [1,1,0,0,0,0|1,0,0]=3 1208 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 MC40267 [1,1,0,0,0,0|1,0,0]=3 1209 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 CS21546 [1,1,0,0,0,0|1,0,0]=3 1210 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 CS10370 [1,1,0,0,0,0|0,0,0]=2 1211 B11R1.166 O=C(O)C1=C(F)C=C(S)C=C1 MC106336 [1,1,0,0,0,0|0,1,0]=3 1212 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 CS17032 [1,1,0,0,0,0|2,0,0]=4 1213 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 CS22743 [1,1,0,0,0,0|1,0,0]=3 1214 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 CS14997 [1,1,0,0,0,0|1,0,0]=3 1215 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 MC442268 [1,1,0,0,0,0|0,0,0]=2 1216 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 MC30324 [1,1,0,0,0,0|1,0,0]=3 1217 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 CS14628 [1,1,0,0,0,0|1,0,0]=3 1218 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 CS14175 [1,1,0,0,0,0|1,0,0]=3 1219 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 MC33215 [1,1,0,0,0,0|0,0,0]=2 1220 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 CS15315 [1,1,0,0,0,0|2,0,0]=4 1221 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br CS13280 [1,1,0,0,0,0|2,0,0]=4 1222 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl MC103222 [1,1,0,0,0,0|2,0,0]=4 1223 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br MC445336 [1,1,0,0,0,0|2,0,0]=4 1224 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl CS15782 [1,1,0,0,0,0|2,0,0]=4 1225 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl CS15170 [1,1,0,0,0,0|1,0,0]=3 1226 B11R1.166 O=C(O)C1=CN=C(O)N=C1O CS13988 [1,1,0,0,0,0|2,0,0]=4 1227 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br MC20838 [1,1,0,0,0,0|2,0,0]=4 1228 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl MC31031 [1,1,0,0,0,0|2,0,0]=4 1229 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F MC429610 [1,1,0,0,0,0|2,0,0]=4 1230 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl CS21897 [1,1,0,0,0,0|2,0,0]=4 1231 B11R1.166 O=C(O)C1=NC=C(F)C=C1Br MC429650 [1,1,0,0,0,0|2,0,0]=4 1232 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl MC430828 [1,1,0,0,0,0|2,0,0]=4 1233 B11R1.166 O=C(O)C1=NC=C(F)C=C1F MC429507 [1,1,0,0,0,0|2,0,0]=4 1234 B11R1.166 O=C([O-])C1=C(F)C=C(F)C=C1 MC40347 [1,1,0,0,0,0|1,0,1]=4 1235 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(O)C=C1 MC106939 [1,1,0,0,0,0|1,0,1]=4 1236 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(O)C=C1 CS15925 [1,1,0,0,0,0|1,0,1]=4 1237 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 CS22937 [1,1,0,0,0,0|1,0,1]=4 1238 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 CS14969 [1,1,0,0,0,0|1,0,1]=4 1239 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 MC442453 [1,1,0,0,0,0|1,0,1]=4 1240 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 MC442907 [1,1,0,0,0,0|1,0,1]=4 1241 B11R1.166 OB(O)C1=C(F)C=C(O)C=C1 MC441701 [1,1,0,0,0,0|1,0,1]=4 1242 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 MC41278 [1,1,0,0,0,0|2,0,0]=4 1243 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 MC41280 [1,1,0,0,0,0|2,0,0]=4 1244 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 MC41284 [1,1,0,0,0,0|2,0,0]=4 1245 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 MC433258 [1,1,0,0,0,0|2,0,0]=4 1246 B11R1.23 COC(=O)C1=CC(=O)NC=C1 CS11585 [1,1,0,0,0,0|1,0,1]=4 1247 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 CS20038 [1,1,0,0,0,0|1,0,0]=3 1248 B11R1.23 COC(=O)C1=CC(C)=CC=C1 MC40113 [1,1,0,0,0,0|1,0,0]=3 1249 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 CS11622 [1,1,0,0,0,0|1,0,0]=3 1250 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 CS18382 [1,1,0,0,0,0|2,0,0]=4 1251 B11R1.23 COC(=O)C1=CC(F)=CC=C1 MC40102 [1,1,0,0,0,0|1,0,0]=3 1252 B11R1.23 COC(=O)C1=CC(I)=CC=C1 CS19204 [1,1,0,0,0,0|1,0,0]=3 1253 B11R1.23 COC(=O)C1=CC(N)=CC=C1 MC40055 [1,1,0,0,0,0|1,0,0]=3 1254 B11R1.23 COC(=O)C1=CC(N)=NC=C1 CS19528 [1,1,0,0,0,0|2,0,0]=4 1255 B11R1.23 COC(=O)C1=CC(N)=NC=C1 MC442551 [1,1,0,0,0,0|2,0,0]=4 1256 B11R1.23 COC(=O)C1=CC(O)=CC=C1 CS13404 [1,1,0,0,0,0|0,0,0]=2 1257 B11R1.23 COC(=O)C1=CC(S)=CC=C1 MC100369 [1,1,0,0,0,0|0,1,0]=3 1258 B11R1.23 COC(=O)C1=CC(S)=NC=C1 MC430617 [1,1,0,0,0,0|1,1,0]=4 1259 B11R1.23 COC(=O)C1=CC=CC(=O)N1 CS15010 [1,1,0,0,0,0|1,0,1]=4 1260 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 CS10403 [1,1,0,0,0,0|2,0,0]=4 1261 B11R1.23 COC(=O)C1=CN=CC(C)=C1 CS11660 [1,1,0,0,0,0|2,0,0]=4 1262 B11R1.23 COC(=O)C1=CN=CC(N)=C1 CS18261 [1,1,0,0,0,0|2,0,0]=4 1263 B11R1.23 COC(=O)C1=CN=CC(O)=C1 CS11658 [1,1,0,0,0,0|1,0,0]=3 1264 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 CS18917 [1,1,0,0,0,0|2,0,0]=4 1265 B11R1.23 COC(=O)C1=NC(C)=CC=C1 CS12275 [1,1,0,0,0,0|2,0,0]=4 1266 B11R1.23 COC(=O)C1=NC(Cl)=CC=C1 CS10671 [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.23 COC(=O)C1=NC(N)=CC=C1 CS10610 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 CS18223 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.23 COC(=O)C1=NC=CC(C)=C1 MC431617 [1,1,0,0,0,0|2,0,0]=4 1270 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 CS14005 [1,1,0,0,0,0|2,0,0]=4 1271 B11R1.23 COC(=O)C1=NC=CC(F)=C1 MC430081 [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 MC429588 [1,1,0,0,0,0|2,0,0]=4 1273 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 MC41245 [1,1,0,0,0,0|2,0,0]=4 1274 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 CS19056 [1,1,0,0,0,0|2,0,0]=4 1275 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 CS15383 [1,1,0,0,0,0|2,0,0]=4 1276 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 MC433217 [1,1,0,0,0,0|1,0,0]=3 1277 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 MC20163 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 MC20584 [1,1,0,0,0,0|1,0,0]=3 1279 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 MC111196 [1,1,0,0,0,0|2,0,0]=4 1280 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 CS11107 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 CS10716 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.74 CC(=O)C1=CC(Cl)=CC(F)=C1 MC41238 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 MC30105 [1,1,0,0,0,0|2,0,0]=4 1284 B11R1.74 CC(=O)c1cc(Br)cc(Br)c1 MC433229 [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 CS12399 [1,1,0,0,0,0|1,0,0]=3 1286 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=C1 CS15533 [1,1,0,0,0,0|1,0,0]=3 1287 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 CS14042 [1,1,0,0,0,0|2,0,0]=4 1288 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 CS14703 [1,1,0,0,0,0|1,0,0]=3 1289 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 CS22319 [1,1,0,0,0,0|0,0,0]=2 1290 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 MC111081 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 CS10680 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 MC20749 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 CS21904 [1,1,0,0,0,0|1,0,0]=3 1294 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 MC433670 [1,1,0,0,0,0|1,0,0]=3 1295 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 MC427308 [1,1,0,0,0,0|2,0,0]=4 1296 B11R1.74 CC1=CC(N)=CC(C(=O)O)=C1 MC20267 [1,1,0,0,0,0|1,0,0]=3 1297 B11R1.74 CC1=CC([N+](=O)[O-])=CC(O)=C1 CS22364 [1,1,0,0,0,0|1,0,1]=4 1298 B11R1.74 NC(=O)C1=CC(Cl)=CC(F)=C1 MC41016 [1,1,0,0,0,0|2,0,0]=4 1299 B11R1.74 NC1=CC(Br)=CC(C(=O)O)=C1 CS22075 [1,1,0,0,0,0|1,0,0]=3 1300 B11R1.74 NC1=CC(C(=O)O)=NC(Br)=C1 MC33509 [1,1,0,0,0,0|2,0,0]=4 1301 B11R1.74 NC1=CC(C(=O)O)=NC(Cl)=C1 MC33512 [1,1,0,0,0,0|2,0,0]=4 1302 B11R1.74 NC1=CC(F)=CC(C(=O)O)=C1 CS10981 [1,1,0,0,0,0|1,0,0]=3 1303 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 MC433642 [1,1,0,0,0,0|1,0,0]=3 1304 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 CS22078 [1,1,0,0,0,0|0,0,0]=2 1305 B11R1.74 O=C(Cl)C1=CC(Br)=CC(Cl)=C1 MC40441 [1,1,0,0,0,0|2,0,0]=4 1306 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(F)=C1 MC40453 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 MC40468 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CS19812 [1,1,0,0,0,0|1,0,0]=3 1309 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 CS12668 [1,1,0,0,0,0|1,0,0]=3 1310 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 CS21917 [1,1,0,0,0,0|1,0,0]=3 1311 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 MC20185 [1,1,0,0,0,0|1,0,0]=3 1312 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 MC40243 [1,1,0,0,0,0|0,0,0]=2 1313 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 CS13909 [1,1,0,0,0,0|2,0,0]=4 1314 B11R1.74 O=C(O)C1=CC(Br)=NC(Cl)=C1 MC431578 [1,1,0,0,0,0|2,0,0]=4 1315 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 CS14664 [1,1,0,0,0,0|1,0,0]=3 1316 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 MC33092 [1,1,0,0,0,0|1,0,0]=3 1317 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 CS22224 [1,1,0,0,0,0|1,0,0]=3 1318 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 CS18670 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 MC30103 [1,1,0,0,0,0|1,0,0]=3 1320 B11R1.74 O=C(O)C1=CC(F)=CC(I)=C1 MC433681 [1,1,0,0,0,0|1,0,0]=3 1321 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 CS14447 [1,1,0,0,0,0|0,0,0]=2 1322 B11R1.74 O=C(O)C1=CC(F)=NC(F)=C1 MC430002 [1,1,0,0,0,0|2,0,0]=4 1323 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 MC433664 [1,1,0,0,0,0|1,0,0]=3 1324 B11R1.74 O=C(O)C1=CC(O)=CC(I)=C1 MC442504 [1,1,0,0,0,0|0,0,0]=2 1325 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 MC20481 [1,1,0,0,0,0|0,0,0]=2 1326 B11R1.74 O=C(O)C1=NC(Br)=CC(Br)=C1 MC442155 [1,1,0,0,0,0|2,0,0]=4 1327 B11R1.74 O=C(O)C1=NC(Br)=CC(Cl)=C1 MC431198 [1,1,0,0,0,0|2,0,0]=4 1328 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 CS17530 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 CS22506 [1,1,0,0,0,0|2,0,0]=4 1330 B11R1.74 O=C(O)C1=NC(Cl)=CC(F)=C1 MC431621 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.74 O=C(O)C1=NC(F)=CC(Br)=C1 MC431181 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.74 O=C(O)c1cc(O)nc(O)c1 CS16429 [1,1,0,0,0,0|1,0,0]=3 1333 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=C1 MC30104 [1,1,0,0,0,0|1,0,1]=4 1334 B11R1.74 O=[N+]([O-])C1=CC(O)=CC(Br)=C1 CS15717 [1,1,0,0,0,0|1,0,1]=4 1335 B11R1.74 OB(O)C1=CC(Cl)=CC(O)=C1 MC442032 [1,1,0,0,0,0|1,0,1]=4 1336 B11R1.74 OB(O)C1=CC(F)=CC(O)=C1 MC441542 [1,1,0,0,0,0|1,0,1]=4 1337 B11R1.155 CC(C)(O)C1=CC=CC(O)=C1 MC105736 [1,1,0,0,0,0|1,0,1]=4 1338 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 MC33077 [1,1,0,0,0,0|2,0,0]=4 1339 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 CS21018 [1,1,0,0,0,0|2,0,0]=4 1340 B11R1.159 CC(=O)C1=C(Cl)C(F)=CC=C1 MC41235 [1,1,0,0,0,0|2,0,0]=4 1341 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 MC20204 [1,1,0,0,0,0|2,0,0]=4 1342 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 MC31073 [1,1,0,0,0,0|2,0,0]=4 1343 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 MC442382 [1,1,0,0,0,0|1,0,0]=3 1344 B11R1.159 CC(=O)C1=C(N)C(F)=CC=C1 MC443630 [1,1,0,0,0,0|2,0,0]=4 1345 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 CS20991 [1,1,0,0,0,0|1,0,0]=3 1346 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 CS20407 [1,1,0,0,0,0|2,0,0]=4 1347 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 CS13325 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 CS10781 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 CS15701 [1,1,0,0,0,0|2,0,0]=4 1350 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 CS20939 [1,1,0,0,0,0|1,0,0]=3 1351 B11R1.159 CC(=O)c1cccc(Br)c1N MC433201 [1,1,0,0,0,0|2,0,0]=4 1352 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O CS17097 [1,1,0,0,0,0|2,0,0]=4 1353 B11R1.159 CC1=C(C(=O)Cl)C=CC=C1Br MC40446 [1,1,0,0,0,0|2,0,0]=4 1354 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br CS10774 [1,1,0,0,0,0|1,0,0]=3 1355 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl CS22209 [1,1,0,0,0,0|1,0,0]=3 1356 B11R1.159 CC1=C(C(=O)O)C=CC=C1F CS20846 [1,1,0,0,0,0|1,0,0]=3 1357 B11R1.159 CC1=C(C(=O)O)C=CC=C1I MC20967 [1,1,0,0,0,0|1,0,0]=3 1358 B11R1.159 CC1=C(C(=O)O)C=CC=C1N CS20997 [1,1,0,0,0,0|1,0,0]=3 1359 B11R1.159 CC1=C(C(=O)O)C=CC=C1O CS20942 [1,1,0,0,0,0|0,0,0]=2 1360 B11R1.159 CC1=C(C(N)=O)C=CC=C1F MC41022 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.159 CC1=C(Cl)C=CN=C1C(=O)O MC442698 [1,1,0,0,0,0|2,0,0]=4 1362 B11R1.159 CC1=C(O)C=CC=C1[N+](=O)[O-] CS14960 [1,1,0,0,0,0|1,0,1]=4 1363 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C MC433669 [1,1,0,0,0,0|2,0,0]=4 1364 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br CS10769 [1,1,0,0,0,0|1,0,0]=3 1365 B11R1.159 CC1=CC=CC(C(=O)O)=C1C CS21070 [1,1,0,0,0,0|1,0,0]=3 1366 B11R1.159 CC1=CC=CC(C(=O)O)=C1F CS21867 [1,1,0,0,0,0|1,0,0]=3 1367 B11R1.159 CC1=CC=CC(C(=O)O)=C1I CS21611 [1,1,0,0,0,0|1,0,0]=3 1368 B11R1.159 CC1=CC=CC(C(=O)O)=C1N CS21804 [1,1,0,0,0,0|1,0,0]=3 1369 B11R1.159 CC1=CC=CC(C(=O)O)=C1O CS16085 [1,1,0,0,0,0|1,0,0]=3 1370 B11R1.159 CN1C=CC=C(C(=O)O)C1=O MC444117 [1,1,0,0,0,0|2,0,0]=4 1371 B11R1.159 NC(=O)C1=C(N)C(Br)=CC=C1 CS15497 [1,1,0,0,0,0|2,0,0]=4 1372 B11R1.159 NC(=O)C1=C(N)C(F)=CC=C1 MC433796 [1,1,0,0,0,0|2,0,0]=4 1373 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 CS10963 [1,1,0,0,0,0|2,0,0]=4 1374 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O CS22569 [1,1,0,0,0,0|2,0,0]=4 1375 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br CS20178 [1,1,0,0,0,0|1,0,0]=3 1376 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl CS20200 [1,1,0,0,0,0|1,0,0]=3 1377 B11R1.159 NC1=C(C(=O)O)C=CC=C1F CS10428 [1,1,0,0,0,0|1,0,0]=3 1378 B11R1.159 NC1=C(C(=O)O)C=CC=C1I CS14916 [1,1,0,0,0,0|1,0,0]=3 1379 B11R1.159 NC1=C(C(=O)O)C=CC=C1O CS20329 [1,1,0,0,0,0|0,0,0]=2 1380 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl CS15165 [1,1,0,0,0,0|2,0,0]=4 1381 B11R1.159 NC1=C(Cl)C(C(=O)O)=NC=C1 MC429875 [1,1,0,0,0,0|2,0,0]=4 1382 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] CS23022 [1,1,0,0,0,0|1,0,1]=4 1383 B11R1.159 NC1=CC=CC(C(=O)O)=C1Cl CS18598 [1,1,0,0,0,0|1,0,0]=3 1384 B11R1.159 NC1=CC=CC(C(=O)O)=C1F CS20007 [1,1,0,0,0,0|1,0,0]=3 1385 B11R1.159 NC1=CC=CC(C(=O)O)=C1N CS13398 [1,1,0,0,0,0|1,0,0]=3 1386 B11R1.159 NC1=CC=CC(C(=O)O)=C1O CS20331 [1,1,0,0,0,0|1,0,0]=3 1387 B11R1.159 NC1=NC=CC(C(=O)O)=C1F MC432389 [1,1,0,0,0,0|2,0,0]=4 1388 B11R1.159 O=C(Cl)C1=C(F)C(Br)=CC=C1 MC433605 [1,1,0,0,0,0|2,0,0]=4 1389 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 MC40452 [1,1,0,0,0,0|2,0,0]=4 1390 B11R1.159 O=C(O)C1=C(Br)C(Br)=CC=C1 CS14427 [1,1,0,0,0,0|1,0,0]=3 1391 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 MC429659 [1,1,0,0,0,0|1,0,0]=3 1392 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 MC433592 [1,1,0,0,0,0|1,0,0]=3 1393 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 MC432289 [1,1,0,0,0,0|2,0,0]=4 1394 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 CS21833 [1,1,0,0,0,0|1,0,0]=3 1395 B11R1.159 O=C(O)C1=C(Br)C(F)=NC=C1 MC432120 [1,1,0,0,0,0|2,0,0]=4 1396 B11R1.159 O=C(O)C1=C(Br)C(O)=CC=C1 MC442312 [1,1,0,0,0,0|0,0,0]=2 1397 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 CS14400 [1,1,0,0,0,0|1,0,0]=3 1398 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 MC432065 [1,1,0,0,0,0|2,0,0]=4 1399 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 MC433645 [1,1,0,0,0,0|1,0,0]=3 1400 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 CS21021 [1,1,0,0,0,0|2,0,0]=4 1401 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 CS19950 [1,1,0,0,0,0|1,0,0]=3 1402 B11R1.159 O=C(O)C1=C(Cl)C(O)=CC=C1 CS14808 [1,1,0,0,0,0|0,0,0]=2 1403 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 CS21913 [1,1,0,0,0,0|1,0,0]=3 1404 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 CS19960 [1,1,0,0,0,0|1,0,0]=3 1405 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 CS19220 [1,1,0,0,0,0|2,0,0]=4 1406 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 MC30136 [1,1,0,0,0,0|1,0,0]=3 1407 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 CS12733 [1,1,0,0,0,0|1,0,0]=3 1408 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 MC20266 [1,1,0,0,0,0|0,0,0]=2 1409 B11R1.159 O=C(O)C1=C(I)C(Cl)=CC=C1 CS15350 [1,1,0,0,0,0|1,0,0]=3 1410 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 CS14251 [1,1,0,0,0,0|1,0,0]=3 1411 B11R1.159 O=C(O)C1=C(I)C(O)=CC=C1 MC442215 [1,1,0,0,0,0|0,0,0]=2 1412 B11R1.159 O=C(O)C1=C(O)C(=O)C=CO1 MC111676 [1,1,0,0,0,0|1,0,1]=4 1413 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 CS19729 [1,1,0,0,0,0|1,0,0]=3 1414 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 CS22246 [1,1,0,0,0,0|1,0,0]=3 1415 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 CS10372 [1,1,0,0,0,0|1,0,0]=3 1416 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 MC20146 [1,1,0,0,0,0|0,0,0]=2 1417 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O CS15968 [1,1,0,0,0,0|2,0,0]=4 1418 B11R1.159 O=C(O)C1=CNC=C(Br)C1=O CS17860 [1,1,0,0,0,0|2,0,0]=4 1419 B11R1.159 O=C(O)C1=NC=CC(Br)=C1F MC432492 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl MC442436 [1,1,0,0,0,0|2,0,0]=4 1421 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1F MC431600 [1,1,0,0,0,0|2,0,0]=4 1422 B11R1.159 O=C(O)c1ccnc(F)c1F CS12552 [1,1,0,0,0,0|2,0,0]=4 1423 B11R1.159 O=C([O-])C1=C(Cl)C(F)=CC=C1 MC40340 [1,1,0,0,0,0|1,0,1]=4 1424 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Br CS17793 [1,1,0,0,0,0|1,0,1]=4 1425 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Cl CS21438 [1,1,0,0,0,0|1,0,1]=4 1426 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1F CS12510 [1,1,0,0,0,0|1,0,1]=4 1427 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 MC441449 [1,1,0,0,0,0|1,0,1]=4 1428 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 CS14948 [1,1,0,0,0,0|2,0,0]=4 1429 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 MC10476 [1,1,0,0,0,0|2,0,0]=4 1430 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 MC41256 [1,1,0,0,0,0|2,0,0]=4 1431 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 MC33032 [1,1,0,0,0,0|2,0,0]=4 1432 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 CS21139 [1,1,0,0,0,0|2,0,0]=4 1433 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 CS10721 [1,1,0,0,0,0|2,0,0]=4 1434 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 CS12150 [1,1,0,0,0,0|2,0,0]=4 1435 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 MC41254 [1,1,0,0,0,0|2,0,0]=4 1436 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 CS18839 [1,1,0,0,0,0|2,0,0]=4 1437 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 MC41223 [1,1,0,0,0,0|2,0,0]=4 1438 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 MC442384 [1,1,0,0,0,0|1,0,0]=3 1439 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 MC10366 [1,1,0,0,0,0|2,0,0]=4 1440 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 CS12985 [1,1,0,0,0,0|2,0,0]=4 1441 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 CS12192 [1,1,0,0,0,0|2,0,0]=4 1442 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 CS15935 [1,1,0,0,0,0|2,0,0]=4 1443 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 MC10135 [1,1,0,0,0,0|2,0,0]=4 1444 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 CS13715 [1,1,0,0,0,0|2,0,0]=4 1445 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 CS20840 [1,1,0,0,0,0|2,0,0]=4 1446 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 MC33295 [1,1,0,0,0,0|2,0,0]=4 1447 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 CS19932 [1,1,0,0,0,0|1,0,0]=3 1448 B11R1.167 CC1=C(C(=O)Cl)C=C(F)C=C1 MC428342 [1,1,0,0,0,0|2,0,0]=4 1449 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 CS20805 [1,1,0,0,0,0|1,0,0]=3 1450 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 CS15972 [1,1,0,0,0,0|2,0,0]=4 1451 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 CS10331 [1,1,0,0,0,0|1,0,0]=3 1452 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 CS22055 [1,1,0,0,0,0|1,0,0]=3 1453 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 CS14966 [1,1,0,0,0,0|1,0,0]=3 1454 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 CS21678 [1,1,0,0,0,0|1,0,0]=3 1455 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 CS10400 [1,1,0,0,0,0|0,0,0]=2 1456 B11R1.167 CC1=C(C(=O)[O-])C=C(F)C=C1 MC30018 [1,1,0,0,0,0|1,0,1]=4 1457 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 CS10493 [1,1,0,0,0,0|1,0,1]=4 1458 B11R1.167 CC1=CC(C(=O)Cl)=C(F)C=C1 MC40479 [1,1,0,0,0,0|2,0,0]=4 1459 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 CS10772 [1,1,0,0,0,0|1,0,0]=3 1460 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 CS21075 [1,1,0,0,0,0|1,0,0]=3 1461 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 CS19779 [1,1,0,0,0,0|1,0,0]=3 1462 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 CS17254 [1,1,0,0,0,0|2,0,0]=4 1463 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 MC40284 [1,1,0,0,0,0|1,0,0]=3 1464 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 CS21612 [1,1,0,0,0,0|1,0,0]=3 1465 B11R1.167 CC1=CC(C(=O)O)=C(I)N=C1 MC429858 [1,1,0,0,0,0|2,0,0]=4 1466 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 CS20992 [1,1,0,0,0,0|1,0,0]=3 1467 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 MC112964 [1,1,0,0,0,0|2,0,0]=4 1468 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 CS14304 [1,1,0,0,0,0|2,0,0]=4 1469 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=N1 MC111079 [1,1,0,0,0,0|2,0,0]=4 1470 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 MC111078 [1,1,0,0,0,0|2,0,0]=4 1471 B11R1.167 CC1=CC=C(F)C(C(=O)O)=N1 MC431567 [1,1,0,0,0,0|2,0,0]=4 1472 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 MC443687 [1,1,0,0,0,0|2,0,0]=4 1473 B11R1.167 CC1=CC=C(O)N=C1C(=O)O MC427108 [1,1,0,0,0,0|1,0,0]=3 1474 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=C1 MC432147 [1,1,0,0,0,0|2,0,0]=4 1475 B11R1.167 NC(=O)C1=C(Br)C=CC(F)=C1 MC430722 [1,1,0,0,0,0|2,0,0]=4 1476 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=C1 CS21271 [1,1,0,0,0,0|2,0,0]=4 1477 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 MC20679 [1,1,0,0,0,0|2,0,0]=4 1478 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 MC41008 [1,1,0,0,0,0|2,0,0]=4 1479 B11R1.167 NC(=O)C1=C(O)C=CC(F)=C1 MC106125 [1,1,0,0,0,0|2,0,0]=4 1480 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O CS15710 [1,1,0,0,0,0|2,0,0]=4 1481 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 CS20261 [1,1,0,0,0,0|1,0,0]=3 1482 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 CS22956 [1,1,0,0,0,0|2,0,0]=4 1483 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 CS20202 [1,1,0,0,0,0|1,0,0]=3 1484 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=N1 CS21275 [1,1,0,0,0,0|2,0,0]=4 1485 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 CS21817 [1,1,0,0,0,0|1,0,0]=3 1486 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 CS20231 [1,1,0,0,0,0|1,0,0]=3 1487 B11R1.167 NC1=C(C(=O)O)C=C(I)C=N1 MC427420 [1,1,0,0,0,0|2,0,0]=4 1488 B11R1.167 NC1=C([N+](=O)[O-])C=C(O)C=C1 CS15276 [1,1,0,0,0,0|1,0,1]=4 1489 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 CS18210 [1,1,0,0,0,0|1,0,0]=3 1490 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 CS20208 [1,1,0,0,0,0|1,0,0]=3 1491 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 MC443227 [1,1,0,0,0,0|2,0,0]=4 1492 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 MC30241 [1,1,0,0,0,0|1,0,0]=3 1493 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 CS16234 [1,1,0,0,0,0|1,0,0]=3 1494 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O MC427091 [1,1,0,0,0,0|2,0,0]=4 1495 B11R1.167 NC1=CN=C(Br)C=C1C(=O)O CS14502 [1,1,0,0,0,0|2,0,0]=4 1496 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O CS15108 [1,1,0,0,0,0|2,0,0]=4 1497 B11R1.167 NC1=CN=C(F)C=C1C(=O)O MC430040 [1,1,0,0,0,0|2,0,0]=4 1498 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(Br)=C1 MC40442 [1,1,0,0,0,0|2,0,0]=4 1499 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 MC40455 [1,1,0,0,0,0|2,0,0]=4 1500 B11R1.167 O=C(Cl)C1=C(F)C=CC(F)=C1 MC40466 [1,1,0,0,0,0|2,0,0]=4 1501 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 CS19808 [1,1,0,0,0,0|1,0,0]=3 1502 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 CS19830 [1,1,0,0,0,0|1,0,0]=3 1503 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 CS19846 [1,1,0,0,0,0|1,0,0]=3 1504 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 MC433609 [1,1,0,0,0,0|1,0,0]=3 1505 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 CS21135 [1,1,0,0,0,0|2,0,0]=4 1506 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 CS15518 [1,1,0,0,0,0|2,0,0]=4 1507 B11R1.167 O=C(O)C1=C(Br)N=CC(F)=C1 MC111567 [1,1,0,0,0,0|2,0,0]=4 1508 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 CS10221 [1,1,0,0,0,0|1,0,0]=3 1509 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 CS19898 [1,1,0,0,0,0|1,0,0]=3 1510 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 MC429399 [1,1,0,0,0,0|1,0,0]=3 1511 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 MC433624 [1,1,0,0,0,0|1,0,0]=3 1512 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 CS21466 [1,1,0,0,0,0|0,0,0]=2 1513 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 CS18656 [1,1,0,0,0,0|2,0,0]=4 1514 B11R1.167 O=C(O)C1=C(Cl)N=CC(Cl)=C1 CS15201 [1,1,0,0,0,0|2,0,0]=4 1515 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 CS14241 [1,1,0,0,0,0|2,0,0]=4 1516 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 MC441067 [1,1,0,0,0,0|1,0,0]=3 1517 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 CS22027 [1,1,0,0,0,0|1,0,0]=3 1518 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 MC40254 [1,1,0,0,0,0|1,0,0]=3 1519 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 MC31113 [1,1,0,0,0,0|1,0,0]=3 1520 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 CS20031 [1,1,0,0,0,0|1,0,0]=3 1521 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 CS10371 [1,1,0,0,0,0|0,0,0]=2 1522 B11R1.167 O=C(O)C1=C(F)N=CC(F)=C1 MC432036 [1,1,0,0,0,0|2,0,0]=4 1523 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 CS10237 [1,1,0,0,0,0|1,0,0]=3 1524 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 MC40257 [1,1,0,0,0,0|1,0,0]=3 1525 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 CS14765 [1,1,0,0,0,0|1,0,0]=3 1526 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 MC433663 [1,1,0,0,0,0|1,0,0]=3 1527 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 CS16232 [1,1,0,0,0,0|1,0,0]=3 1528 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 CS14141 [1,1,0,0,0,0|1,0,0]=3 1529 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 CS10374 [1,1,0,0,0,0|1,0,0]=3 1530 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 CS18796 [1,1,0,0,0,0|2,0,0]=4 1531 B11R1.167 O=C(O)C1=C(S)C=CC(Br)=C1 MC115165 [1,1,0,0,0,0|1,0,0]=3 1532 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br CS13289 [1,1,0,0,0,0|2,0,0]=4 1533 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl MC427412 [1,1,0,0,0,0|2,0,0]=4 1534 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F MC433044 [1,1,0,0,0,0|2,0,0]=4 1535 B11R1.167 O=C(O)C1=CC(Cl)=CNC1=O MC427347 [1,1,0,0,0,0|2,0,0]=4 1536 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Br CS17555 [1,1,0,0,0,0|2,0,0]=4 1537 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl CS16218 [1,1,0,0,0,0|2,0,0]=4 1538 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F CS19538 [1,1,0,0,0,0|2,0,0]=4 1539 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br MC442809 [1,1,0,0,0,0|2,0,0]=4 1540 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Cl MC33514 [1,1,0,0,0,0|2,0,0]=4 1541 B11R1.167 O=C(O)C1=NC(Br)=CC=C1F MC429615 [1,1,0,0,0,0|2,0,0]=4 1542 B11R1.167 O=C(O)C1=NC(Br)=CC=C1O CS12800 [1,1,0,0,0,0|2,0,0]=4 1543 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br CS13146 [1,1,0,0,0,0|2,0,0]=4 1544 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl CS18671 [1,1,0,0,0,0|2,0,0]=4 1545 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F MC20813 [1,1,0,0,0,0|2,0,0]=4 1546 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl CS16420 [1,1,0,0,0,0|1,0,0]=3 1547 B11R1.167 O=C([O-])C1=C(Cl)C=CC(Cl)=C1 MC40344 [1,1,0,0,0,0|1,0,1]=4 1548 B11R1.167 O=C([O-])C1=C(F)C=CC(F)=C1 MC30171 [1,1,0,0,0,0|1,0,1]=4 1549 B11R1.167 O=C1C=C(C(=O)O)C(Br)=CN1 MC427563 [1,1,0,0,0,0|1,0,1]=4 1550 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(O)=C1 CS19331 [1,1,0,0,0,0|1,0,1]=4 1551 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(O)=C1 MC20557 [1,1,0,0,0,0|1,0,1]=4 1552 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(O)=C1 CS18896 [1,1,0,0,0,0|1,0,1]=4 1553 B11R1.167 OB(O)C1=C(Cl)C=CC(O)=C1 MC441700 [1,1,0,0,0,0|1,0,1]=4 1554 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 MC441423 [1,1,0,0,0,0|1,0,1]=4 1555 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 MC33169 [1,1,0,0,0,0|2,0,0]=4 1556 B11R1.266 CC(=O)c1cccc(CCl)c1 MC30280 [1,1,0,0,0,0|2,0,0]=4 1557 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 CS21756 [1,1,0,0,0,0|2,0,0]=4 1558 B11R1.266 CNC1=CC(C(=O)O)=CN=C1 MC33524 [1,1,0,0,0,0|2,0,0]=4 1559 B11R1.266 CNC1=CC=CC(C(=O)O)=N1 CS18139 [1,1,0,0,0,0|2,0,0]=4 1560 B11R1.266 COC1=CC(C(=O)O)=CN=C1 CS20059 [1,1,0,0,0,0|1,0,0]=3 1561 B11R1.266 COC1=CC(C(=O)O)=CN=N1 CS17802 [1,1,0,0,0,0|2,0,0]=4 1562 B11R1.266 COC1=CC(C(=O)O)=NC=C1 CS20334 [1,1,0,0,0,0|1,0,0]=3 1563 B11R1.266 COC1=CC(C(=O)O)=NC=N1 MC441129 [1,1,0,0,0,0|2,0,0]=4 1564 B11R1.266 COC1=CC(C(C)=O)=NC=C1 MC442668 [1,1,0,0,0,0|2,0,0]=4 1565 B11R1.266 COC1=CC=CC(B(O)O)=C1 CS20399 [1,1,0,0,0,0|1,0,1]=4 1566 B11R1.266 COC1=CC=CC(C(=N)N)=C1 CS18198 [1,1,0,0,0,0|2,0,0]=4 1567 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 MC40493 [1,1,0,0,0,0|1,0,0]=3 1568 B11R1.266 COC1=CC=CC(C(=O)O)=C1 MC40298 [1,1,0,0,0,0|0,0,0]=2 1569 B11R1.266 COC1=CC=CC(C(=O)O)=N1 CS18200 [1,1,0,0,0,0|1,0,0]=3 1570 B11R1.266 COC1=CN=CC(C(=O)O)=N1 CS14316 [1,1,0,0,0,0|2,0,0]=4 1571 B11R1.266 COC1=CN=NC(C(=O)O)=C1 MC116095 [1,1,0,0,0,0|2,0,0]=4 1572 B11R1.266 COC1=NC=CC(C(=O)O)=C1 CS10487 [1,1,0,0,0,0|1,0,0]=3 1573 B11R1.266 COC1=NC=CC(C(=O)O)=N1 MC441255 [1,1,0,0,0,0|2,0,0]=4 1574 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 MC20560 [1,1,0,0,0,0|2,0,0]=4 1575 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 MC433634 [1,1,0,0,0,0|1,0,0]=3 1576 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 CS14616 [1,1,0,0,0,0|2,0,0]=4 1577 B11R1.266 NC(=O)C1=CC(CBr)=CC=C1 CS16760 [1,1,0,0,0,0|2,0,0]=4 1578 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 MC434007 [1,1,0,0,0,0|2,0,0]=4 1579 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 CS21006 [1,1,0,0,0,0|1,0,0]=3 1580 B11R1.266 O=C(Cl)C1=CC(CCl)=CC=C1 MC40457 [1,1,0,0,0,0|2,0,0]=4 1581 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 MC30291 [1,1,0,0,0,0|1,0,0]=3 1582 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 CS18966 [1,1,0,0,0,0|1,0,0]=3 1583 B11R1.266 O=C(O)C1=NC(CBr)=CC=C1 MC431950 [1,1,0,0,0,0|2,0,0]=4 1584 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 CS21920 [1,1,0,0,0,0|0,0,1]=3 1585 B11R1.266 O=CC1=NC=CC(C(=O)O)=C1 CS15759 [1,1,0,0,0,0|1,0,1]=4 1586 B11R1.266 O=[N+]([O-])C1=CC=CC(CO)=C1 MC40724 [1,1,0,0,0,0|1,0,1]=4 1587 B11R1.266 OCC1=CC=CC(B(O)O)=C1 CS21893 [1,1,0,0,0,0|1,0,1]=4 1588 B11R1.14 CC1=C(F)C=C(C=O)C=C1Br CS14266 [1,1,0,0,0,0|2,0,0]=4 1589 B11R1.14 CC1=CC(C=O)=CC(C)=C1Br CS21651 [1,1,0,0,0,0|2,0,0]=4 1590 B11R1.14 CC1=CC(C=O)=CC(C)=C1O CS21079 [1,1,0,0,0,0|1,0,0]=3 1591 B11R1.14 O=CC1=CC(Br)=C(Br)C(F)=C1 MC108815 [1,1,0,0,0,0|2,0,0]=4 1592 B11R1.14 O=CC1=CC(Br)=C(F)C(Cl)=C1 MC107931 [1,1,0,0,0,0|2,0,0]=4 1593 B11R1.14 O=CC1=CC(Br)=C(O)C(F)=C1 CS16316 [1,1,0,0,0,0|1,0,0]=3 1594 B11R1.14 O=CC1=CC(Br)=C(O)C(O)=C1 MC442474 [1,1,0,0,0,0|0,0,0]=2 1595 B11R1.14 O=CC1=CC(Cl)=C(Cl)C(F)=C1 MC433427 [1,1,0,0,0,0|2,0,0]=4 1596 B11R1.14 O=CC1=CC(Cl)=C(F)C(Cl)=C1 MC433428 [1,1,0,0,0,0|2,0,0]=4 1597 B11R1.14 O=CC1=CC(Cl)=C(O)C(Cl)=C1 CS19903 [1,1,0,0,0,0|1,0,0]=3 1598 B11R1.14 O=CC1=CC(F)=C(Br)C(F)=C1 MC41089 [1,1,0,0,0,0|2,0,0]=4 1599 B11R1.14 O=CC1=CC(F)=C(Cl)C(F)=C1 MC430963 [1,1,0,0,0,0|2,0,0]=4 1600 B11R1.14 O=CC1=CC(F)=C(F)C(F)=C1 MC20027 [1,1,0,0,0,0|2,0,0]=4 1601 B11R1.14 O=CC1=CC(F)=C(O)C(F)=C1 CS20018 [1,1,0,0,0,0|1,0,0]=3 1602 B11R1.14 O=CC1=CC(I)=C(O)C(I)=C1 MC433433 [1,1,0,0,0,0|1,0,0]=3 1603 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 CS21918 [1,1,0,0,0,0|0,0,0]=2 1604 B11R1.192 NCCC1=CC=C(O)C(O)=C1 CS15345 [1,1,0,0,0,0|1,0,1]=4 1605 B11R1.192 O=CCC1=CC(Br)=C(F)C=C1 MC430543 [1,1,0,0,0,0|2,0,0]=4 1606 B11R1.192 O=CCC1=CC(F)=C(Br)C=C1 MC430272 [1,1,0,0,0,0|2,0,0]=4 1607 B11R1.277 CC1=C(C=O)C=C(F)C(Br)=C1 MC433411 [1,1,0,0,0,0|2,0,0]=4 1608 B11R1.277 CC1=CC(Br)=C(C=O)C=C1F MC433410 [1,1,0,0,0,0|2,0,0]=4 1609 B11R1.277 CC1=CC(C=O)=C(Br)C=C1F MC433409 [1,1,0,0,0,0|2,0,0]=4 1610 B11R1.277 CC1=CC(C=O)=C(C)C=C1Cl MC433415 [1,1,0,0,0,0|2,0,0]=4 1611 B11R1.277 CC1=CC(C=O)=C(C)C=C1O CS19366 [1,1,0,0,0,0|1,0,0]=3 1612 B11R1.277 CC1=CC(C=O)=C(F)C=C1Br MC20029 [1,1,0,0,0,0|2,0,0]=4 1613 B11R1.277 CC1=CC(F)=C(C=O)C=C1Br CS12699 [1,1,0,0,0,0|2,0,0]=4 1614 B11R1.277 CC1=CC(O)=C(C)C=C1N=O MC41188 [1,1,0,0,0,0|2,0,0]=4 1615 B11R1.277 O=CC1=C(Br)C=C(Br)C(F)=C1 MC108811 [1,1,0,0,0,0|2,0,0]=4 1616 B11R1.277 O=CC1=C(Br)C=C(F)C(Br)=C1 MC431878 [1,1,0,0,0,0|2,0,0]=4 1617 B11R1.277 O=CC1=C(Br)C=C(F)C(Cl)=C1 MC107929 [1,1,0,0,0,0|2,0,0]=4 1618 B11R1.277 O=CC1=C(Br)C=C(F)C(F)=C1 MC433074 [1,1,0,0,0,0|2,0,0]=4 1619 B11R1.277 O=CC1=C(Cl)C=C(Br)C(F)=C1 CS12690 [1,1,0,0,0,0|2,0,0]=4 1620 B11R1.277 O=CC1=C(Cl)C=C(Cl)C(F)=C1 MC433424 [1,1,0,0,0,0|2,0,0]=4 1621 B11R1.277 O=CC1=C(Cl)C=C(F)C(F)=C1 CS10172 [1,1,0,0,0,0|2,0,0]=4 1622 B11R1.277 O=CC1=C(F)C=C(Br)C(Br)=C1 MC108816 [1,1,0,0,0,0|2,0,0]=4 1623 B11R1.277 O=CC1=C(F)C=C(Br)C(F)=C1 CS16187 [1,1,0,0,0,0|2,0,0]=4 1624 B11R1.277 O=CC1=C(F)C=C(Cl)C(Br)=C1 MC106340 [1,1,0,0,0,0|2,0,0]=4 1625 B11R1.277 O=CC1=C(F)C=C(Cl)C(F)=C1 CS10174 [1,1,0,0,0,0|2,0,0]=4 1626 B11R1.277 O=CC1=C(F)C=C(F)C(Br)=C1 MC41090 [1,1,0,0,0,0|2,0,0]=4 1627 B11R1.277 O=CC1=C(F)C=C(F)C(Cl)=C1 CS10176 [1,1,0,0,0,0|2,0,0]=4 1628 B11R1.277 O=CC1=C(F)C=C(F)C(F)=C1 CS10199 [1,1,0,0,0,0|2,0,0]=4 1629 B11R1.277 O=CC1=C(F)C=C(F)C(I)=C1 MC106245 [1,1,0,0,0,0|2,0,0]=4 1630 B11R1.277 O=CC1=C(F)C=C(O)C(F)=C1 MC442309 [1,1,0,0,0,0|1,0,0]=3 1631 B11R1.277 O=CC1=C(O)C=C(Cl)C(F)=C1 MC443676 [1,1,0,0,0,0|2,0,0]=4 1632 B11R1.277 O=CC1=C(O)C=C(F)C(F)=C1 MC20589 [1,1,0,0,0,0|2,0,0]=4 1633 B11R1.278 CC1=C(Br)C(F)=C(C=O)C=C1 MC443356 [1,1,0,0,0,0|2,0,0]=4 1634 B11R1.278 CC1=C(C=O)C=CC(F)=C1F CS17527 [1,1,0,0,0,0|2,0,0]=4 1635 B11R1.278 CC1=C(F)C(F)=C(C=O)C=C1 MC430055 [1,1,0,0,0,0|2,0,0]=4 1636 B11R1.278 CC1=C(F)C=CC(C=O)=C1Cl CS16312 [1,1,0,0,0,0|2,0,0]=4 1637 B11R1.278 CC1=C(F)C=CC(C=O)=C1F CS21103 [1,1,0,0,0,0|2,0,0]=4 1638 B11R1.278 CC1=C(O)C=CC(C=O)=C1O CS15354 [1,1,0,0,0,0|1,0,0]=3 1639 B11R1.278 O=CC1=C(Br)C(Br)=C(F)C=C1 MC108808 [1,1,0,0,0,0|2,0,0]=4 1640 B11R1.278 O=CC1=C(Br)C(F)=C(Br)C=C1 MC108810 [1,1,0,0,0,0|2,0,0]=4 1641 B11R1.278 O=CC1=C(Cl)C(O)=C(Cl)C=C1 CS15848 [1,1,0,0,0,0|1,0,0]=3 1642 B11R1.278 O=CC1=C(F)C(Br)=C(Br)C=C1 MC108814 [1,1,0,0,0,0|2,0,0]=4 1643 B11R1.278 O=CC1=C(F)C(Cl)=C(F)C=C1 MC41101 [1,1,0,0,0,0|2,0,0]=4 1644 B11R1.278 O=CC1=C(F)C(F)=C(Br)C=C1 CS14416 [1,1,0,0,0,0|2,0,0]=4 1645 B11R1.278 O=CC1=C(F)C(F)=C(Br)C=C1 MC433076 [1,1,0,0,0,0|2,0,0]=4 1646 B11R1.278 O=CC1=C(F)C(F)=C(F)C=C1 MC30123 [1,1,0,0,0,0|2,0,0]=4 1647 B11R1.278 O=CC1=C(F)C(F)=C(I)C=C1 CS15042 [1,1,0,0,0,0|2,0,0]=4 1648 B11R1.278 O=CC1=C(F)C(F)=C(O)C=C1 CS21025 [1,1,0,0,0,0|1,0,0]=3 1649 B11R1.278 O=CC1=C(F)C(O)=C(F)C=C1 CS15755 [1,1,0,0,0,0|1,0,0]=3 1650 B11R1.278 O=CC1=C(O)C(O)=C(O)C=C1 CS20987 [1,1,0,0,0,0|0,0,0]=2 1651 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 MC30287 [1,1,0,0,0,0|1,0,0]=3 1652 B11R1.279 COC1=C(C)C=C(C=O)C=C1 CS10892 [1,1,0,0,0,0|1,0,0]=3 1653 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 MC41105 [1,1,0,0,0,0|1,0,0]=3 1654 B11R1.279 COC1=C(F)C=C(C=O)C=C1 MC30257 [1,1,0,0,0,0|1,0,0]=3 1655 B11R1.279 COC1=C(N)C=C(C=O)C=C1 CS22069 [1,1,0,0,0,0|1,0,0]=3 1656 B11R1.279 COC1=C(O)C=C(C#N)C=C1 CS14799 [1,1,0,0,0,0|1,0,1]=4 1657 B11R1.279 COC1=C(O)C=C(C=O)C=C1 CS15324 [1,1,0,0,0,0|0,0,0]=2 1658 B11R1.279 COC1=C(O)C=C(CO)C=C1 CS22314 [1,1,0,0,0,0|0,0,1]=3 1659 B11R1.279 COC1=CC(O)=C(OC)C=C1 CS21149 [1,1,0,0,0,0|2,0,0]=4 1660 B11R1.279 COC1=NC=C(C=O)C=C1Br MC430406 [1,1,0,0,0,0|2,0,0]=4 1661 B11R1.279 COC1=NC=C(C=O)C=C1F MC115933 [1,1,0,0,0,0|2,0,0]=4 1662 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 CS21640 [1,1,0,0,0,0|1,0,0]=3 1663 B11R1.280 CC1=C(C#N)C=C(C=O)C=C1 MC41111 [1,1,0,0,0,0|2,0,0]=4 1664 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 MC441223 [1,1,0,0,0,0|1,0,0]=3 1665 B11R1.280 COC1=C(Br)C=CC(CO)=C1 CS21375 [1,1,0,0,0,0|1,0,1]=4 1666 B11R1.280 COC1=C(C)C=CC(C=O)=C1 CS21938 [1,1,0,0,0,0|1,0,0]=3 1667 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 CS15135 [1,1,0,0,0,0|1,0,0]=3 1668 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 CS17422 [1,1,0,0,0,0|1,0,1]=4 1669 B11R1.280 COC1=C(F)C=CC(C=O)=C1 MC429581 [1,1,0,0,0,0|1,0,0]=3 1670 B11R1.280 COC1=C(F)C=CC(CO)=C1 MC40713 [1,1,0,0,0,0|1,0,1]=4 1671 B11R1.280 COC1=C(O)C=CC(C#N)=C1 MC40664 [1,1,0,0,0,0|1,0,1]=4 1672 B11R1.280 COC1=C(O)C=CC(C=O)=C1 CS13553 [1,1,0,0,0,0|0,0,0]=2 1673 B11R1.280 COC1=C(O)C=CC(CN)=C1 CS22873 [1,1,0,0,0,0|1,0,1]=4 1674 B11R1.280 COC1=C(O)C=CC(CO)=C1 MC40721 [1,1,0,0,0,0|0,0,1]=3 1675 B11R1.280 COC1=CC(OC)=C(O)C=C1 CS21112 [1,1,0,0,0,0|2,0,0]=4 1676 B11R1.280 N#CC1=C(Br)C=CC(C=O)=C1 CS14722 [1,1,0,0,0,0|2,0,0]=4 1677 B11R1.280 N#CC1=C(Cl)C=CC(C=O)=C1 CS17615 [1,1,0,0,0,0|2,0,0]=4 1678 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 CS20608 [1,1,0,0,0,0|2,0,0]=4 1679 B11R1.280 N#CC1=C(I)C=CC(C=O)=C1 MC431062 [1,1,0,0,0,0|2,0,0]=4 1680 B11R1.865 COC(=O)C1=C(O)C(Cl)=CS1 CS12918 [0,1,0,0,1,0|2,0,0]=4 1681 B13R1.35 COC1=C(Br)C=C(CC(=O)O)C=C1 MC40149 [0,1,0,0,0,1|1,0,0]=3 1682 B13R1.35 COC1=C(C)C=C(CC(=O)O)C=C1 CS11122 [0,1,0,0,0,1|1,0,0]=3 1683 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 MC40168 [0,1,0,0,0,1|1,0,0]=3 1684 B13R1.35 COC1=C(F)C=C(NC(C)=O)C=C1 MC106799 [0,1,0,0,0,1|2,0,0]=4 1685 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 CS19593 [0,1,0,0,0,1|1,0,0]=3 1686 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 MC433954 [0,1,0,0,0,1|0,0,0]=2 1687 B13R1.52 N#CC1=C(Cl)C=CC(CC(=O)O)=C1 MC40153 [0,1,0,0,0,1|2,0,0]=4 1688 B13R1.52 N#CC1=C(F)C=CC(CC(=O)O)=C1 MC433945 [0,1,0,0,0,1|2,0,0]=4 1689 B13R1.510 NC(C(=O)O)C1=CC(F)=C(F)C=C1 MC429427 [0,1,0,0,0,1|2,0,0]=4 1690 B13R1.876 CC1=CC(Cl)=C(CC(=O)O)C=C1Cl MC109948 [0,1,0,0,0,1|2,0,0]=4 1691 B13R1.876 O=C(O)CC1=C(Br)C=C(Br)C(F)=C1 MC109031 [0,1,0,0,0,1|2,0,0]=4 1692 B13R1.876 O=C(O)CC1=C(Br)C=C(F)C(Br)=C1 MC109033 [0,1,0,0,0,1|2,0,0]=4 1693 B13R1.876 O=C(O)CC1=C(F)C=C(Br)C(Br)=C1 MC109040 [0,1,0,0,0,1|2,0,0]=4 1694 B13R1.876 O=C(O)CC1=C(F)C=C(Cl)C(Cl)=C1 MC109750 [0,1,0,0,0,1|2,0,0]=4 1695 B13R1.876 O=C(O)CC1=C(F)C=C(F)C(F)=C1 CS20651 [0,1,0,0,0,1|2,0,0]=4 1696 B13R1.2879 COC(=O)CC1=CC(Cl)=C(O)C=C1 MC433941 [0,1,0,0,0,1|1,0,0]=3 1697 B13R1.2879 COC(=O)CC1=CC(F)=C(C)C=C1 CS15702 [0,1,0,0,0,1|2,0,0]=4 1698 B13R1.2879 COC(=O)CC1=CC(N)=C(Cl)C=C1 CS16914 [0,1,0,0,0,1|2,0,0]=4 1699 B13R1.2879 COC(=O)CC1=CC(O)=C(Br)C=C1 MC429707 [0,1,0,0,0,1|1,0,0]=3 1700 B13R1.2879 COC(=O)NC1=CC(F)=C(Br)C=C1 MC40071 [0,1,0,0,0,1|2,0,0]=4 1701 B13R1.3528 O=C(O)CC1=C(Br)C(Br)=C(F)C=C1 MC109027 [0,1,0,0,0,1|2,0,0]=4 1702 B13R1.3528 O=C(O)CC1=C(Br)C(F)=C(Br)C=C1 MC109030 [0,1,0,0,0,1|2,0,0]=4 1703 B13R1.3528 O=C(O)CC1=C(F)C(Br)=C(Br)C=C1 MC109036 [0,1,0,0,0,1|2,0,0]=4 1704 B13R1.3763 CC1=C(Cl)C=C(CC(=O)O)C=C1Cl MC109950 [0,1,0,0,0,1|2,0,0]=4 1705 B13R1.3763 CC1=CC(CC(=O)O)=CC(F)=C1F MC110304 [0,1,0,0,0,1|2,0,0]=4 1706 B13R1.3763 O=C(O)CC1=CC(Br)=C(Br)C(F)=C1 MC109037 [0,1,0,0,0,1|2,0,0]=4 1707 B13R1.3763 O=C(O)CC1=CC(Br)=C(F)C(Br)=C1 MC109038 [0,1,0,0,0,1|2,0,0]=4 1708 B13R1.3763 O=C(O)CC1=CC(Br)=C(O)C(Br)=C1 MC40161 [0,1,0,0,0,1|1,0,0]=3 1709 B13R1.3763 O=C(O)CC1=CC(Cl)=C(Cl)C(F)=C1 MC109747 [0,1,0,0,0,1|2,0,0]=4 1710 B13R1.3763 O=C(O)CC1=CC(Cl)=C(F)C(Cl)=C1 MC109749 [0,1,0,0,0,1|2,0,0]=4 1711 B13R1.3763 O=C(O)CC1=CC(F)=C(F)C(F)=C1 MC40194 [0,1,0,0,0,1|2,0,0]=4 1712 B13R1.7922 O=S(=O)(O)C1=CC(Cl)=C(O)C(Cl)=C1 MC115173 [0,2,0,0,0,0|2,0,0]=4 1713 B13R1.120 CC1=C(C(=O)O)C=CC(C(=O)O)=C1 MC425501 [0,2,0,0,0,0|1,0,0]=3 1714 B13R1.120 CC1=C([N+](=O)[O-])C=CC(C(=O)O)=C1 MC40306 [0,2,0,0,0,0|1,0,1]=4 1715 B13R1.120 NC1=C(C(=O)O)C=CC(C(=O)O)=C1 CS20866 [0,2,0,0,0,0|1,0,0]=3 1716 B13R1.120 O=C(O)C1=C(O)C=C([N+](=O)[O-])C=C1 CS20154 [0,2,0,0,0,0|1,0,1]=4 1717 B13R1.120 O=C(O)C1=CC(Br)=C(C(=O)O)C=C1 MC40321 [0,2,0,0,0,0|1,0,0]=3 1718 B13R1.120 O=C(O)C1=CC(Br)=C(C(F)F)C=C1 MC429790 [0,2,0,0,0,0|2,0,0]=4 1719 B13R1.120 O=C(O)C1=CC(Br)=C([N+](=O)[O-])C=C1 CS17790 [0,2,0,0,0,0|1,0,1]=4 1720 B13R1.120 O=C(O)C1=CC(Cl)=C(B(O)O)C=C1 CS21993 [0,2,0,0,0,0|1,0,0]=3 1721 B13R1.120 O=C(O)C1=CC(Cl)=C([N+](=O)[O-])C=C1 CS14271 [0,2,0,0,0,0|1,0,1]=4 1722 B13R1.120 O=C(O)C1=CC(F)=C(C(=O)O)C=C1 MC429505 [0,2,0,0,0,0|1,0,0]=3 1723 B13R1.120 O=C(O)C1=CC(F)=C([N+](=O)[O-])C=C1 CS20033 [0,2,0,0,0,0|1,0,1]=4 1724 B13R1.120 O=C(O)C1=CC(I)=C(C(=O)O)C=C1 MC433999 [0,2,0,0,0,0|1,0,0]=3 1725 B13R1.120 O=C(O)C1=CC(O)=C(C(=O)O)C=C1 CS21606 [0,2,0,0,0,0|0,0,0]=2 1726 B13R1.120 O=C(O)C1=CC(O)=C([N+](=O)[O-])C=C1 CS10381 [0,2,0,0,0,0|0,0,1]=3 1727 B13R1.120 O=C(O)C1=NC(Cl)=C(C(=O)O)C=C1 MC442152 [0,2,0,0,0,0|2,0,0]=4 1728 B13R1.652 COC1=CC(Cl)=C(C(=O)O)C=C1Cl CS17728 [0,2,0,0,0,0|1,0,0]=3 1729 B13R1.652 COC1=CC(F)=C(C(=O)O)C=C1F MC429640 [0,2,0,0,0,0|1,0,0]=3 1730 B13R1.652 COC1=CC(N)=C(C(=O)O)C=C1Br MC30208 [0,2,0,0,0,0|1,0,0]=3 1731 B13R1.652 COC1=CC(N)=C(C(=O)O)C=C1F MC104813 [0,2,0,0,0,0|1,0,0]=3 1732 B13R1.652 N#CC1=CC(Br)=C(C(=O)O)C=C1F MC108144 [0,2,0,0,0,0|2,0,0]=4 1733 B13R1.652 N#CC1=CC(Br)=C(C(=O)O)C=C1I MC108306 [0,2,0,0,0,0|2,0,0]=4 1734 B13R1.652 N#CC1=CC(Br)=C(C(=O)O)C=C1O MC108255 [0,2,0,0,0,0|1,0,0]=3 1735 B13R1.652 N#CC1=CC(F)=C(C(=O)O)C=C1Br MC108158 [0,2,0,0,0,0|2,0,0]=4 1736 B13R1.652 N#CC1=CC(I)=C(C(=O)O)C=C1Br MC108322 [0,2,0,0,0,0|2,0,0]=4 1737 B13R1.652 N#CC1=CC(O)=C(C(=O)O)C=C1Br MC108269 [0,2,0,0,0,0|2,0,0]=4 1738 B13R1.3088 COC(=O)C1=CC(Br)=C(C#N)C=C1 MC427582 [0,2,0,0,0,0|2,0,0]=4 1739 B13R1.3088 COC(=O)C1=CC(Br)=C(C=O)C=C1 CS16856 [0,2,0,0,0,0|1,0,1]=4 1740 B13R1.3088 COC(=O)C1=CC(C)=C(C#N)C=C1 CS12676 [0,2,0,0,0,0|2,0,0]=4 1741 B13R1.3088 COC(=O)C1=CC(C)=C(OC)N=C1 MC115595 [0,2,0,0,0,0|2,0,0]=4 1742 B13R1.3088 COC(=O)C1=CC(Cl)=C(C#N)C=C1 CS15776 [0,2,0,0,0,0|2,0,0]=4 1743 B13R1.3088 COC(=O)C1=CC(Cl)=C(CBr)C=C1 CS11634 [0,2,0,0,0,0|2,0,0]=4 1744 B13R1.3088 COC(=O)C1=CC(F)=C(C#N)C=C1 MC40091 [0,2,0,0,0,0|2,0,0]=4 1745 B13R1.3088 COC(=O)C1=CC(F)=C(C=O)C=C1 CS15741 [0,2,0,0,0,0|1,0,1]=4 1746 B13R1.3088 COC(=O)C1=CC(F)=C(CBr)C=C1 CS22688 [0,2,0,0,0,0|2,0,0]=4 1747 B13R1.3088 COC(=O)C1=CC(F)=C(CO)C=C1 CS15475 [0,2,0,0,0,0|1,0,0]=3 1748 B13R1.3088 COC(=O)C1=CC(I)=C(OC)C=C1 MC40107 [0,2,0,0,0,0|1,0,0]=3 1749 B13R1.3088 COC(=O)C1=CC(N)=C(CN)C=C1 MC40054 [0,2,0,0,0,0|2,0,0]=4 1750 B13R1.3088 COC(=O)C1=CC(N)=C(OC)C=C1 MC40060 [0,2,0,0,0,0|1,0,0]=3 1751 B13R1.3088 COC(=O)C1=CC(O)=C(OC)C=C1 CS11624 [0,2,0,0,0,0|0,0,0]=2 1752 B13R1.3088 COC(=O)C1=CC(O)=C(OC)N=C1 MC430370 [0,2,0,0,0,0|1,0,0]=3 1753 B13R1.3088 COC(=O)C1=CN=C(OC)C(Br)=C1 CS16557 [0,2,0,0,0,0|2,0,0]=4 1754 B13R1.3088 COC(=O)C1=CN=C(OC)C(Cl)=C1 MC443202 [0,2,0,0,0,0|2,0,0]=4 1755 B13R1.3088 COC(=O)C1=CN=C(OC)C(F)=C1 CS17219 [0,2,0,0,0,0|2,0,0]=4 1756 B13R1.3088 COC(=O)C1=NC(N)=C(OC)C=C1 MC432302 [0,2,0,0,0,0|2,0,0]=4 1757 B13R1.3088 COC(=O)C1=NC=C(OC)C(Cl)=C1 MC104264 [0,2,0,0,0,0|2,0,0]=4 1758 B13R1.3091 COC1=C(CCl)C=C(C(C)=O)C=C1 MC41241 [0,2,0,0,0,0|2,0,0]=4 1759 B13R1.3091 COC1=C(OC)C=C(B(O)O)C=C1 MC445050 [0,2,0,0,0,0|1,0,1]=4 1760 B13R1.3091 COC1=C(OC)C=C(C(=O)Cl)C=C1 MC40469 [0,2,0,0,0,0|1,0,0]=3 1761 B13R1.3091 COC1=C(OC)C=C(C(=O)O)C=C1 MC40279 [0,2,0,0,0,0|0,0,0]=2 1762 B13R1.3096 COC1=C(C)C(N)=C(C(C)=O)C=C1 MC10451 [0,2,0,0,0,0|2,0,0]=4 1763 B13R1.3096 COC1=C(F)C(F)=C(C(=O)O)C=C1 MC433658 [0,2,0,0,0,0|1,0,0]=3 1764 B13R1.3096 N#CC1=C(F)C(F)=C(C(=O)O)C=C1 MC431382 [0,2,0,0,0,0|2,0,0]=4 1765 B13R1.3380 COC1=C(C)C=C(C(=O)O)C=C1C CS10021 [0,2,0,0,0,0|1,0,0]=3 1766 B13R1.3380 COC1=C(F)C=C(C(=O)O)C=C1F CS21989 [0,2,0,0,0,0|1,0,0]=3 1767 B13R1.3380 N#CC1=C(Br)C=C(C(=O)O)C=C1F MC108149 [0,2,0,0,0,0|2,0,0]=4 1768 B13R1.3380 N#CC1=C(Br)C=C(C(=O)O)C=C1I MC108312 [0,2,0,0,0,0|2,0,0]=4 1769 B13R1.3380 N#CC1=C(Br)C=C(C(=O)O)C=C1O MC108261 [0,2,0,0,0,0|1,0,0]=3 1770 B13R1.3380 O=CC1=C(Cl)C=C(C(=O)O)C=C1Cl MC443470 [0,2,0,0,0,0|1,0,1]=4 1771 B13R1.3380 O=CC1=C(F)C=C(C(=O)O)C=C1F MC20214 [0,2,0,0,0,0|1,0,1]=4 1772 B13R1.13 CC(=O)C1=CC(B(O)O)=C(Cl)C=C1 MC441511 [0,2,0,0,0,0|2,0,0]=4 1773 B13R1.13 CC(=O)C1=CC([N+](=O)[O-])=C(O)C=C1 CS15399 [0,2,0,0,0,0|1,0,1]=4 1774 B13R1.13 CC1=C([N+](=O)[O-])C=C(C(=O)O)C=C1 CS20864 [0,2,0,0,0,0|1,0,1]=4 1775 B13R1.13 O=C(O)C1=C(O)C=CC(B(O)O)=C1 MC441698 [0,2,0,0,0,0|1,0,1]=4 1776 B13R1.13 O=C(O)C1=CC(B(O)O)=C(Cl)C=C1 CS10310 [0,2,0,0,0,0|1,0,0]=3 1777 B13R1.13 O=C(O)C1=CC(C(=O)O)=C(Br)C=C1 MC40322 [0,2,0,0,0,0|1,0,0]=3 1778 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(Br)C=C1 MC30329 [0,2,0,0,0,0|1,0,1]=4 1779 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(Cl)C=C1 CS16389 [0,2,0,0,0,0|1,0,1]=4 1780 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(F)C=C1 CS22002 [0,2,0,0,0,0|1,0,1]=4 1781 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(I)C=C1 CS22902 [0,2,0,0,0,0|1,0,1]=4 1782 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(O)C=C1 CS15294 [0,2,0,0,0,0|0,0,1]=3 1783 B13R1.49 CCC(=O)C1=CC(OC)=C(O)C=C1 CS22875 [0,2,0,0,0,0|1,0,0]=3 1784 B13R1.49 CNC1=C(N)C=CC(C(=O)OC)=C1 CS16777 [0,2,0,0,0,0|2,0,0]=4 1785 B13R1.49 COC(=O)C1=CC(C#N)=C(F)C=C1 CS19260 [0,2,0,0,0,0|2,0,0]=4 1786 B13R1.49 COC(=O)C1=CC(CCl)=C(Cl)C=C1 MC40079 [0,2,0,0,0,0|2,0,0]=4 1787 B13R1.49 COC(=O)C1=CC(OC)=C(Br)C=C1 CS11640 [0,2,0,0,0,0|1,0,0]=3 1788 B13R1.49 COC(=O)C1=CC(OC)=C(C)C=C1 CS11629 [0,2,0,0,0,0|1,0,0]=3 1789 B13R1.49 COC(=O)C1=CC(OC)=C(Cl)C=C1 MC40084 [0,2,0,0,0,0|1,0,0]=3 1790 B13R1.49 COC(=O)C1=CC(OC)=C(I)C=C1 MC40108 [0,2,0,0,0,0|1,0,0]=3 1791 B13R1.49 COC(=O)C1=CC(OC)=C(N)C=C1 CS10901 [0,2,0,0,0,0|1,0,0]=3 1792 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 CS21130 [0,2,0,0,0,0|0,0,0]=2 1793 B13R1.49 COC(=O)C1=NC(OC)=C(Br)C=C1 MC432584 [0,2,0,0,0,0|2,0,0]=4 1794 B13R1.49 COC(=O)C1=NC(OC)=C(C)C=C1 MC428184 [0,2,0,0,0,0|2,0,0]=4 1795 B13R1.49 COC(=O)C1=NC=C(Br)C(OC)=C1 MC431901 [0,2,0,0,0,0|2,0,0]=4 1796 B13R1.49 O=C(CBr)C1=CC(CO)=C(O)C=C1 MC425697 [0,2,0,0,0,0|1,0,0]=3 1797 B13R1.49 O=CC1=C(O)C=CC(C(=O)CBr)=C1 MC427112 [0,2,0,0,0,0|1,0,1]=4 1798 B13R1.298 COC1=CC(B(O)O)=CC(Cl)=C1O MC113640 [0,2,0,0,0,0|1,0,1]=4 1799 B13R1.298 COC1=CC(C(=O)O)=CC(Cl)=C1O MC40256 [0,2,0,0,0,0|0,0,0]=2 1800 B13R1.298 N#CC1=C(Br)C(F)=CC(C(=O)O)=C1 MC108153 [0,2,0,0,0,0|2,0,0]=4 1801 B13R1.298 N#CC1=C(Br)C(I)=CC(C(=O)O)=C1 MC108317 [0,2,0,0,0,0|2,0,0]=4 1802 B13R1.298 N#CC1=C(Br)C(O)=CC(C(=O)O)=C1 MC108266 [0,2,0,0,0,0|1,0,0]=3 1803 B13R1.298 N#CC1=CC(C(=O)O)=CC(Br)=C1F MC108150 [0,2,0,0,0,0|2,0,0]=4 1804 B13R1.298 N#CC1=CC(C(=O)O)=CC(Br)=C1I MC108314 [0,2,0,0,0,0|2,0,0]=4 1805 B13R1.298 N#CC1=CC(C(=O)O)=CC(Br)=C1O MC108263 [0,2,0,0,0,0|1,0,0]=3 1806 B13R1.298 O=CC1=C(O)C(O)=CC([N+](=O)[O-])=C1 MC428142 [0,2,0,0,0,0|1,0,1]=4 1807 B13R1.354 CCCC1=C(F)C=CC(C(=O)O)=C1 CS16016 [0,2,0,0,0,0|2,0,0]=4 1808 B13R1.651 COC1=CC(C(=O)O)=C(Br)C=C1F MC30076 [0,2,0,0,0,0|1,0,0]=3 1809 B13R1.651 COC1=CC(C(=O)O)=C(F)C=C1C MC433685 [0,2,0,0,0,0|1,0,0]=3 1810 B13R1.651 COC1=CC(C(=O)O)=C(F)C=C1N CS12719 [0,2,0,0,0,0|1,0,0]=3 1811 B13R1.651 COC1=CC(C(C)=O)=C(C)C=C1O MC429367 [0,2,0,0,0,0|1,0,0]=3 1812 B13R1.651 COC1=CC(C(C)=O)=C(F)C=C1O MC41252 [0,2,0,0,0,0|1,0,0]=3 1813 B13R1.651 COc1cc(C(C)=O)c(N)cc1F MC433206 [0,2,0,0,0,0|2,0,0]=4 1814 B13R1.651 N#CC1=CC(C(=O)O)=C(Br)C=C1I MC108309 [0,2,0,0,0,0|2,0,0]=4 1815 B13R1.651 N#CC1=CC(C(=O)O)=C(Br)C=C1O MC108258 [0,2,0,0,0,0|1,0,0]=3 1816 B13R1.651 N#CC1=CC(C(=O)O)=C(F)C=C1Br MC108154 [0,2,0,0,0,0|2,0,0]=4 1817 B13R1.651 N#CC1=CC(C(=O)O)=C(I)C=C1Br MC108318 [0,2,0,0,0,0|2,0,0]=4 1818 B13R1.3230 COC1=C(Br)C=CC(C(=O)O)=C1C MC102544 [0,2,0,0,0,0|1,0,0]=3 1819 B13R1.3230 COC1=C(Br)C=CC(C(=O)O)=C1F MC443146 [0,2,0,0,0,0|1,0,0]=3 1820 B13R1.3230 COC1=C(Cl)C=CC(C(=O)O)=C1Cl MC433652 [0,2,0,0,0,0|1,0,0]=3 1821 B13R1.3230 COC1=C(F)C=CC(C(=O)O)=C1F MC30157 [0,2,0,0,0,0|1,0,0]=3 1822 B13R1.3230 COC1=C(F)C=CC(C(=O)O)=C1N CS14710 [0,2,0,0,0,0|1,0,0]=3 1823 B13R1.3230 COC1=C(O)C=CC(C(=O)O)=C1N MC442451 [0,2,0,0,0,0|0,0,0]=2 1824 B13R1.1807 COC(=O)C1=C(Br)C=C(Br)C(F)=C1 MC108873 [0,2,0,0,0,0|2,0,0]=4 1825 B13R1.1807 COC(=O)C1=C(Br)C=C(Cl)C(F)=C1 MC107938 [0,2,0,0,0,0|2,0,0]=4 1826 B13R1.1807 COC(=O)C1=C(Br)C=C(F)C(F)=C1 MC433596 [0,2,0,0,0,0|2,0,0]=4 1827 B13R1.1807 COC(=O)C1=C(C)C=C(N)C(Br)=C1 MC30011 [0,2,0,0,0,0|2,0,0]=4 1828 B13R1.1807 COC(=O)C1=C(C)C=C(N)C(C)=C1 MC433577 [0,2,0,0,0,0|2,0,0]=4 1829 B13R1.1807 COC(=O)C1=C(C)C=C(N)C(I)=C1 MC427466 [0,2,0,0,0,0|2,0,0]=4 1830 B13R1.1807 COC(=O)C1=C(C)C=C(O)C(C)=C1 CS15568 [0,2,0,0,0,0|1,0,0]=3 1831 B13R1.1807 COC(=O)C1=C(Cl)C=C(Cl)C(C)=C1 MC109860 [0,2,0,0,0,0|2,0,0]=4 1832 B13R1.1807 COC(=O)C1=C(Cl)C=C(F)C(F)=C1 MC40081 [0,2,0,0,0,0|2,0,0]=4 1833 B13R1.1807 COC(=O)C1=C(Cl)C=C(F)C(N)=C1 CS17488 [0,2,0,0,0,0|2,0,0]=4 1834 B13R1.1807 COC(=O)C1=C(F)C=C(C)C(O)=C1 MC433677 [0,2,0,0,0,0|1,0,0]=3 1835 B13R1.1807 COC(=O)C1=C(F)C=C(Cl)C(Br)=C1 MC432183 [0,2,0,0,0,0|2,0,0]=4 1836 B13R1.1807 COC(=O)C1=C(F)C=C(F)C(F)=C1 MC40123 [0,2,0,0,0,0|2,0,0]=4 1837 B13R1.1807 COC(=O)C1=C(F)C=C(F)C(N)=C1 CS11651 [0,2,0,0,0,0|2,0,0]=4 1838 B13R1.1807 COC(=O)C1=C(F)C=C(O)C(Br)=C1 MC112253 [0,2,0,0,0,0|1,0,0]=3 1839 B13R1.1807 COC(=O)C1=C(N)C=C(C)C(F)=C1 MC40059 [0,2,0,0,0,0|2,0,0]=4 1840 B13R1.1807 COC(=O)C1=C(N)C=C(Cl)C(Br)=C1 CS11598 [0,2,0,0,0,0|2,0,0]=4 1841 B13R1.1807 COC(=O)C1=C(N)C=C(F)C(C)=C1 MC431160 [0,2,0,0,0,0|2,0,0]=4 1842 B13R1.1807 COC(=O)C1=C(N)C=C(F)C(F)=C1 CS19667 [0,2,0,0,0,0|2,0,0]=4 1843 B13R1.1807 COC(=O)C1=C(O)C=C(Br)C(F)=C1 MC433607 [0,2,0,0,0,0|2,0,0]=4 1844 B13R1.1807 COC(=O)C1=C(O)C=C(C)C(Br)=C1 MC30045 [0,2,0,0,0,0|2,0,0]=4 1845 B13R1.2398 COC1=C(C(=O)O)C=C(Cl)C(Cl)=C1 CS17671 [0,2,0,0,0,0|2,0,0]=4 1846 B13R1.2398 COC1=C(C(=O)O)C=C(Cl)C(N)=C1 CS20904 [0,2,0,0,0,0|2,0,0]=4 1847 B13R1.2398 COC1=C(C(=O)O)C=C(F)C(F)=C1 MC40277 [0,2,0,0,0,0|2,0,0]=4 1848 B13R1.2398 N#CC1=C(C(=O)O)C=C(Br)C(F)=C1 MC108156 [0,2,0,0,0,0|2,0,0]=4 1849 B13R1.2398 N#CC1=C(C(=O)O)C=C(Br)C(I)=C1 MC108320 [0,2,0,0,0,0|2,0,0]=4 1850 B13R1.2398 N#CC1=C(C(=O)O)C=C(Br)C(O)=C1 MC108268 [0,2,0,0,0,0|1,0,0]=3 1851 B13R1.2398 N#CC1=C(C(=O)O)C=C(F)C(Br)=C1 MC108151 [0,2,0,0,0,0|2,0,0]=4 1852 B13R1.2398 N#CC1=C(C(=O)O)C=C(I)C(Br)=C1 MC108315 [0,2,0,0,0,0|2,0,0]=4 1853 B13R1.2398 N#CC1=C(C(=O)O)C=C(O)C(Br)=C1 MC108264 [0,2,0,0,0,0|1,0,0]=3 1854 B13R1.2398 O=CC1=C([N+](=O)[O-])C=C(O)C(O)=C1 MC443516 [0,2,0,0,0,0|1,0,1]=4 1855 B13R1.2811 CC1=C(F)C(F)=C(C(=O)O)C=C1Cl MC102559 [0,2,0,0,0,0|2,0,0]=4 1856 B13R1.2811 CC1=C(F)C(F)=CC(C(=O)O)=C1F CS20654 [0,2,0,0,0,0|2,0,0]=4 1857 B13R1.2811 NC1=C(F)C(F)=C(C(=O)O)C=C1Br MC433563 [0,2,0,0,0,0|2,0,0]=4 1858 B13R1.2811 O=C(O)C1=C(Cl)C(Br)=C(F)C(F)=C1 MC121210 [0,2,0,0,0,0|2,0,0]=4 1859 B13R1.2811 O=C(O)C1=C(Cl)C(Cl)=C(Cl)C(F)=C1 MC433691 [0,2,0,0,0,0|2,0,0]=4 1860 B13R1.2811 O=C(O)C1=C(F)C(Br)=C(F)C(F)=C1 MC433613 [0,2,0,0,0,0|2,0,0]=4 1861 B13R1.2811 O=C(O)C1=C(F)C(Cl)=C(F)C(F)=C1 MC20024 [0,2,0,0,0,0|2,0,0]=4 1862 B13R1.2811 O=C(O)C1=C(F)C(Cl)=C(F)C(I)=C1 MC443300 [0,2,0,0,0,0|2,0,0]=4 1863 B13R1.2811 O=C(O)C1=C(F)C(F)=C(Cl)C(O)=C1 MC429636 [0,2,0,0,0,0|1,0,0]=3 1864 B13R1.2811 O=C(O)C1=C(F)C(F)=C(F)C(F)=C1 CS19641 [0,2,0,0,0,0|2,0,0]=4 1865 B13R1.2811 O=C(O)C1=C(F)C(O)=C(F)C(F)=C1 MC433700 [0,2,0,0,0,0|1,0,0]=3 1866 B13R1.2811 O=C(O)C1=NC(Cl)=C(Cl)C(O)=C1Cl MC114190 [0,2,0,0,0,0|2,0,0]=4 1867 B13R1.2811 O=C(O)C1=NC(O)=C(Cl)C(Cl)=C1Cl MC114196 [0,2,0,0,0,0|2,0,0]=4 1868 B13R1.2812 CC1=C(C(=O)O)C(F)=CC(F)=C1F MC20233 [0,2,0,0,0,0|2,0,0]=4 1869 B13R1.2812 CC1=C(F)C=C(Cl)C(C(=O)O)=C1F MC102573 [0,2,0,0,0,0|2,0,0]=4 1870 B13R1.2812 CC1=C(F)C=C(F)C(C(=O)O)=C1F MC102562 [0,2,0,0,0,0|2,0,0]=4 1871 B13R1.2812 O=C(O)C1=C(F)C(F)=C(F)C=C1F MC433714 [0,2,0,0,0,0|2,0,0]=4 1872 B13R1.466 CCOC(=O)C1=CC(Br)=C(N)C=C1 CS18437 [0,2,0,0,0,0|2,0,0]=4 1873 B13R1.466 CCOC(=O)C1=CC(Cl)=C(F)C=C1 MC40033 [0,2,0,0,0,0|2,0,0]=4 1874 B13R1.466 CCOC(=O)C1=CC(F)=C(N)C=C1 CS12761 [0,2,0,0,0,0|2,0,0]=4 1875 B13R1.466 CCOC(=O)C1=CC(N)=C(C)C=C1 CS12913 [0,2,0,0,0,0|2,0,0]=4 1876 B13R1.466 CCOC(=O)C1=CC(N)=C(F)C=C1 CS21053 [0,2,0,0,0,0|2,0,0]=4 1877 B13R1.466 CCOC(=O)C1=CC(N)=C(N)C=C1 MC40037 [0,2,0,0,0,0|2,0,0]=4 1878 B13R1.466 CCOC(=O)C1=CC(O)=C(Br)C=C1 MC443174 [0,2,0,0,0,0|1,0,0]=3 1879 B13R1.466 CCOC(=O)C1=CC(O)=C(O)C=C1 CS10893 [0,2,0,0,0,0|0,0,0]=2 1880 B13R1.466 CCOC(=O)C1=CN=C(Cl)C(O)=C1 MC429676 [0,2,0,0,0,0|2,0,0]=4 1881 B13R1.1808 COC(=O)C1=C(Br)C(Br)=C(F)C=C1 MC108870 [0,2,0,0,0,0|2,0,0]=4 1882 B13R1.1808 COC(=O)C1=C(Br)C(F)=C(Br)C=C1 MC108872 [0,2,0,0,0,0|2,0,0]=4 1883 B13R1.1808 COC(=O)C1=C(C)C(N)=C(C)C=C1 MC30163 [0,2,0,0,0,0|2,0,0]=4 1884 B13R1.1808 COC(=O)C1=C(C)C(O)=C(Br)C=C1 MC443769 [0,2,0,0,0,0|1,0,0]=3 1885 B13R1.1808 COC(=O)C1=C(C)C(O)=C(Cl)C=C1 MC443284 [0,2,0,0,0,0|1,0,0]=3 1886 B13R1.1808 COC(=O)C1=C(Cl)C(Br)=C(Cl)C=C1 CS17645 [0,2,0,0,0,0|2,0,0]=4 1887 B13R1.1808 COC(=O)C1=C(Cl)C(F)=C(Cl)C=C1 MC109645 [0,2,0,0,0,0|2,0,0]=4 1888 B13R1.1808 COC(=O)C1=C(Cl)C(N)=C(Cl)C=C1 CS17646 [0,2,0,0,0,0|2,0,0]=4 1889 B13R1.1808 COC(=O)C1=C(F)C(Br)=C(Br)C=C1 MC108876 [0,2,0,0,0,0|2,0,0]=4 1890 B13R1.1808 COC(=O)C1=C(F)C(Br)=C(F)C=C1 MC102547 [0,2,0,0,0,0|2,0,0]=4 1891 B13R1.1808 COC(=O)C1=C(F)C(F)=C(Br)C=C1 MC108424 [0,2,0,0,0,0|2,0,0]=4 1892 B13R1.1808 COC(=O)C1=C(F)C(F)=C(C)C=C1 MC431598 [0,2,0,0,0,0|2,0,0]=4 1893 B13R1.1808 COC(=O)C1=C(O)C(Br)=C(N)C=C1 MC100025 [0,2,0,0,0,0|2,0,0]=4 1894 B13R1.1808 COC(=O)c1ccc(N)c(F)c1F MC30130 [0,2,0,0,0,0|2,0,0]=4 1895 B13R1.2678 COC(=O)C1=CC(Br)=C(C)C(Br)=C1 MC40094 [0,2,0,0,0,0|2,0,0]=4 1896 B13R1.2678 COC(=O)C1=CC(Br)=C(N)C(F)=C1 MC425272 [0,2,0,0,0,0|2,0,0]=4 1897 B13R1.2678 COC(=O)C1=CC(Br)=C(O)C(F)=C1 MC112255 [0,2,0,0,0,0|1,0,0]=3 1898 B13R1.2678 COC(=O)C1=CC(C)=C(Br)C(C)=C1 MC433600 [0,2,0,0,0,0|2,0,0]=4 1899 B13R1.2678 COC(=O)C1=CC(C)=C(Cl)C(C)=C1 MC40082 [0,2,0,0,0,0|2,0,0]=4 1900 B13R1.2678 COC(=O)C1=CC(C)=C(N)C(C)=C1 MC31116 [0,2,0,0,0,0|2,0,0]=4 1901 B13R1.2678 COC(=O)C1=CC(Cl)=C(Cl)C(F)=C1 MC109646 [0,2,0,0,0,0|2,0,0]=4 1902 B13R1.2678 COC(=O)C1=CC(Cl)=C(N)C(C)=C1 MC433566 [0,2,0,0,0,0|2,0,0]=4 1903 B13R1.2678 COC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 MC40095 [0,2,0,0,0,0|1,0,0]=3 1904 B13R1.2678 COC(=O)C1=CC(Cl)=C(O)C(O)=C1 MC443646 [0,2,0,0,0,0|0,0,0]=2 1905 B13R1.2678 COC(=O)C1=CC(F)=C(Br)C(F)=C1 MC108425 [0,2,0,0,0,0|2,0,0]=4 1906 B13R1.2678 COC(=O)C1=CC(F)=C(C)C(O)=C1 MC433678 [0,2,0,0,0,0|1,0,0]=3 1907 B13R1.2678 COC(=O)C1=CC(F)=C(F)C(F)=C1 MC40124 [0,2,0,0,0,0|2,0,0]=4 1908 B13R1.2678 COC(=O)C1=CC(F)=C(O)C(O)=C1 MC443645 [0,2,0,0,0,0|0,0,0]=2 1909 B13R1.2678 COC(=O)C1=CC(I)=C(N)C(C)=C1 MC30265 [0,2,0,0,0,0|2,0,0]=4 1910 B13R1.2678 COC(=O)C1=CC(N)=C(C)C(F)=C1 MC433580 [0,2,0,0,0,0|2,0,0]=4 1911 B13R1.2678 COC(=O)C1=CC(O)=C(O)C(O)=C1 MC427038 [0,2,0,0,0,0|0,0,0]=2 1912 B13R1.3158 COC1=C(C(=O)O)C=CC(Cl)=C1Cl CS17672 [0,2,0,0,0,0|2,0,0]=4 1913 B13R1.3158 COC1=C(C(=O)O)C=CC(F)=C1F MC30093 [0,2,0,0,0,0|2,0,0]=4 1914 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 CS16516 [0,0,1,1,0,0|2,0,0]=4 1915 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 CS13542 [0,0,1,1,0,0|1,0,1]=4 1916 B11R1.53 O=CC1=C(C(=O)O)C=CC=N1 CS17869 [0,0,1,1,0,0|1,0,1]=4 1917 B13R2.13083 O=C1NC2=C(C=C(Br)C(Cl)=C2)O1 CS11077 [0,0,0,1,0,1|2,0,0]=4 1918 B13R2.430 CC(=O)C1=CC2=C(C=C1)CCO2 MC442785 [0,1,0,1,0,0|2,0,0]=4 1919 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCO2 CS11018 [0,1,0,1,0,0|1,0,0]=3 1920 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCO2 CS21041 [0,1,0,1,0,0|1,0,0]=3 1921 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 MC31130 [0,1,0,1,0,0|1,1,0]=4 1922 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=NN2 CS18134 [0,1,0,1,0,0|2,0,0]=4 1923 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=N2 CS13765 [0,1,0,1,0,0|2,0,0]=4 1924 B13R2.430 O=C(O)C1=CC2=C(C=C1)NN=N2 CS20140 [0,1,0,1,0,0|2,0,0]=4 1925 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 CS21477 [0,1,0,1,0,0|1,0,0]=3 1926 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 MC441149 [0,1,0,1,0,0|1,1,0]=4 1927 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=N2 CS10225 [0,1,0,1,0,0|1,1,0]=4 1928 B13R2.430 O=C(O)C1=CC2=C(C=CO2)C=C1 MC441167 [0,1,0,1,0,0|1,0,0]=3 1929 B13R2.430 O=C(O)C1=CC2=C(C=CS2)C=C1 MC441150 [0,1,0,1,0,0|1,1,0]=4 1930 B13R2.430 O=C(O)C1=CC2=NNN=C2C=C1 CS18133 [0,1,0,1,0,0|2,0,0]=4 1931 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 CS22275 [0,1,0,1,0,0|2,0,0]=4 1932 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 MC444507 [0,1,0,1,0,0|2,0,0]=4 1933 B13R2.430 O=C(O)C1=CC=C2NC=CC2=C1 CS22274 [0,1,0,1,0,0|2,0,0]=4 1934 B13R2.430 O=C(O)C1=CC=C2NN=CC2=C1 CS13050 [0,1,0,1,0,0|2,0,0]=4 1935 B13R2.430 O=C(O)C1=NC=C2OC=CC2=C1 CS14661 [0,1,0,1,0,0|2,0,0]=4 1936 B13R2.430 OB(O)C1=CC2=C(C=C1)OCO2 CS18560 [0,1,0,1,0,0|1,0,1]=4 1937 B13R2.5180 CC1=C(O)C=CC2=C1COC2=O MC425574 [0,1,0,1,0,0|1,0,0]=3 1938 B9R1.35 CC1=CC(C(=O)O)=CN1 CS15830 [1,0,0,0,1,0|2,0,0]=4 1939 B9R1.35 CC1=CC=C(C(=O)O)O1 CS19440 [1,0,0,0,1,0|2,0,0]=4 1940 B9R1.35 CC1=CC=C(C(=O)O)S1 CS23027 [1,0,0,0,1,0|2,0,0]=4 1941 B9R1.35 CC1=COC(C(=O)O)=C1 MC104342 [1,0,0,0,1,0|2,0,0]=4 1942 B9R1.35 CN1C=CC(C(=O)O)=C1 MC441014 [1,0,0,0,1,0|2,0,0]=4 1943 B9R1.35 Cc1coc(C(=O)O)c1 MC104343 [1,0,0,0,1,0|2,0,0]=4 1944 B9R1.35 O=C(O)C1=CC(Br)=CN1 CS22700 [1,0,0,0,1,0|2,0,0]=4 1945 B9R1.35 O=C(O)C1=CC(Br)=CO1 CS10558 [1,0,0,0,1,0|2,0,0]=4 1946 B9R1.35 O=C(O)C1=CC(Br)=CS1 CS22681 [1,0,0,0,1,0|2,0,0]=4 1947 B9R1.35 O=C(O)C1=CC(O)=NO1 CS13360 [1,0,0,0,1,0|2,0,0]=4 1948 B9R1.35 O=C(O)C1=CC=C(Br)N1 CS16375 [1,0,0,0,1,0|2,0,0]=4 1949 B9R1.35 O=C(O)C1=CC=C(Br)O1 CS22685 [1,0,0,0,1,0|2,0,0]=4 1950 B9R1.35 O=C(O)C1=CC=C(Br)S1 CS17287 [1,0,0,0,1,0|2,0,0]=4 1951 B9R1.35 O=C(O)C1=CC=C(Cl)O1 CS10327 [1,0,0,0,1,0|2,0,0]=4 1952 B9R1.35 O=C(O)C1=CC=C(Cl)S1 CS17350 [1,0,0,0,1,0|2,0,0]=4 1953 B9R1.35 O=C(O)C1=CSC(Br)=C1 MC441053 [1,0,0,0,1,0|2,0,0]=4 1954 B9R1.35 O=C(O)C1=CSC(Cl)=C1 CS10357 [1,0,0,0,1,0|2,0,0]=4 1955 B9R1.35 O=C(O)C1=CSC(F)=C1 MC105198 [1,0,0,0,1,0|2,0,0]=4 1956 B9R1.35 O=C(O)c1cc(F)cs1 MC430853 [1,0,0,0,1,0|2,0,0]=4 1957 B9R1.41 CC1=C(C(=O)O)C=CO1 CS21668 [1,0,0,0,1,0|2,0,0]=4 1958 B9R1.41 CC1=C(C(=O)O)C=CS1 CS21702 [1,0,0,0,1,0|2,0,0]=4 1959 B9R1.41 CC1=C(C(=O)O)NC=C1 MC106666 [1,0,0,0,1,0|2,0,0]=4 1960 B9R1.41 CC1=C(C(=O)O)SC=C1 CS23026 [1,0,0,0,1,0|2,0,0]=4 1961 B9R1.41 CC1=CSC=C1C(=O)O CS14827 [1,0,0,0,1,0|2,0,0]=4 1962 B9R1.41 O=C(O)C1=C(Br)C=CS1 CS17286 [1,0,0,0,1,0|2,0,0]=4 1963 B9R1.41 O=C(O)C1=C(Br)SC=C1 CS21343 [1,0,0,0,1,0|2,0,0]=4 1964 B9R1.41 O=C(O)C1=C(Cl)C=CS1 MC20302 [1,0,0,0,1,0|2,0,0]=4 1965 B9R1.41 O=C(O)C1=C(Cl)SC=C1 CS12218 [1,0,0,0,1,0|2,0,0]=4 1966 B9R1.41 O=C(O)C1=C(F)C=CS1 CS21775 [1,0,0,0,1,0|2,0,0]=4 1967 B9R1.41 O=C(O)C1=C(S)C=CS1 MC116754 [1,0,0,0,1,0|1,1,0]=4 1968 B9R1.41 O=C(O)C1=CSC=C1Br MC442191 [1,0,0,0,1,0|2,0,0]=4 1969 B9R1.41 O=C(O)c1ccsc1F MC430854 [1,0,0,0,1,0|2,0,0]=4 1970 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 MC10315 [1,0,0,0,0,1|2,0,0]=4 1971 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CS22844 [1,0,0,0,0,1|2,0,0]=4 1972 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 MC428013 [1,0,0,0,0,1|2,0,0]=4 1973 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 MC33116 [1,0,0,0,0,1|2,0,0]=4 1974 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 MC40002 [1,0,0,0,0,1|2,0,0]=4 1975 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 MC20138 [1,0,0,0,0,1|2,0,0]=4 1976 B11R1.20 CC(=O)OC1=CC=C(I)C=C1 MC103137 [1,0,0,0,0,1|2,0,0]=4 1977 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS21084 [1,0,0,0,0,1|1,0,0]=3 1978 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 MC429948 [1,0,0,0,0,1|2,0,0]=4 1979 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 CS14692 [1,0,0,0,0,1|2,0,0]=4 1980 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS21002 [1,0,0,0,0,1|1,0,0]=3 1981 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 MC434070 [1,0,0,0,0,1|2,0,0]=4 1982 B11R1.20 O=C(Cl)Oc1ccc(F)cc1 MC434069 [1,0,0,0,0,1|2,0,0]=4 1983 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS20812 [1,0,0,0,0,1|1,0,0]=3 1984 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 MC40158 [1,0,0,0,0,1|1,0,0]=3 1985 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 CS10817 [1,0,0,0,0,1|1,0,0]=3 1986 B11R1.20 O=C(O)CC1=CC=C(F)N=C1 MC429488 [1,0,0,0,0,1|2,0,0]=4 1987 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 CS20852 [1,0,0,0,0,1|1,0,0]=3 1988 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 MC40180 [1,0,0,0,0,1|0,0,0]=2 1989 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 MC40184 [1,0,0,0,0,1|0,1,0]=3 1990 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 CS13319 [1,0,0,0,0,1|2,0,0]=4 1991 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 CS14073 [1,0,0,0,0,1|2,0,0]=4 1992 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 CS22187 [1,0,0,0,0,1|2,0,0]=4 1993 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 MC33114 [1,0,0,0,0,1|2,0,0]=4 1994 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 CS22093 [1,0,0,0,0,1|2,0,0]=4 1995 B11R1.157 CC(=O)OC1=CC(Br)=CC=C1 MC40001 [1,0,0,0,0,1|2,0,0]=4 1996 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 MC40008 [1,0,0,0,0,1|2,0,0]=4 1997 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 MC40004 [1,0,0,0,0,1|2,0,0]=4 1998 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 MC431740 [1,0,0,0,0,1|2,0,0]=4 1999 B11R1.157 Cc1cccc(CC(=O)O)c1 MC433961 [1,0,0,0,0,1|1,0,0]=3 2000 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 CS21911 [1,0,0,0,0,1|1,0,0]=3 2001 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 CS10775 [1,0,0,0,0,1|1,0,0]=3 2002 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 CS21923 [1,0,0,0,0,1|1,0,0]=3 2003 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 MC40173 [1,0,0,0,0,1|1,0,0]=3 2004 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 MC431564 [1,0,0,0,0,1|2,0,0]=4 2005 B11R1.157 O=C(O)CC1=CC(F)=NC=C1 MC430121 [1,0,0,0,0,1|2,0,0]=4 2006 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 CS20851 [1,0,0,0,0,1|1,0,0]=3 2007 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 CS20944 [1,0,0,0,0,1|0,0,0]=2 2008 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 CS12801 [1,0,0,0,0,1|2,0,0]=4 2009 B13R1.511 O=C(O)CCC1=CC(F)=C(Cl)C=C1 CS13209 [0,0,0,0,0,2|2,0,0]=4 2010 B13R1.511 O=C(O)CCC1=CC(F)=C(F)C=C1 MC40201 [0,0,0,0,0,2|2,0,0]=4 2011 B13R1.511 O=C(O)\C=C\C1=CC(Br)=C(F)C=C1 MC433907 [0,0,0,0,0,2|2,0,0]=4 2012 B13R1.511 O=C(O)\C=C\C1=CC(Cl)=C(F)C=C1 MC20199 [0,0,0,0,0,2|2,0,0]=4 2013 B13R1.511 O=C(O)\C=C\C1=CC(F)=C(F)C=C1 CS21437 [0,0,0,0,0,2|2,0,0]=4