0 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [0,0,0,0,0,0|1,0,0]=1 1 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,0,0,0,0,0|2,0,0]=2 2 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,0,0,0,0,0|1,0,0]=1 3 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,0,0,0,0,0|2,0,0]=2 4 B10R1.13 CC(=O)C1=CN=C(O)C=N1 2581AA [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 0919AB [0,0,0,0,0,0|3,0,0]=3 6 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [0,0,0,0,0,0|2,0,1]=3 12 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,0,0,0,0,0|1,0,0]=1 15 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [0,0,0,0,0,0|2,0,1]=3 16 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [0,0,0,0,0,0|1,0,1]=2 18 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 3942AL [0,0,0,0,0,0|1,0,3]=4 20 B10R1.13 CC1=CN=C(B(O)O)C=C1 X0752 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.13 CC1=CN=C(C(=N)N)C=N1 1246AC [0,0,0,0,0,0|4,0,0]=4 22 B10R1.13 CC1=CN=C(C(=N)N)C=N1 2786AA [0,0,0,0,0,0|4,0,0]=4 23 B10R1.13 CC1=NC=C(B(O)O)C=C1 Z7105 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 CC1=NC=C([N+](=O)[O-])C=N1 6835AA [0,0,0,0,0,0|4,0,0]=4 25 B10R1.13 CC1=NN=C(C(=O)O)C=C1 Y9703 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6241AL [0,0,0,0,0,0|4,0,0]=4 27 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6486AL [0,0,0,0,0,0|4,0,0]=4 28 B10R1.13 CN(C)C1=NC=C(N)C=C1 6679AB [0,0,0,0,0,0|4,0,0]=4 29 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [0,0,0,0,0,0|1,0,2]=3 33 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,0,0,0,0,0|2,0,1]=3 34 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [0,0,0,0,0,0|1,0,2]=3 35 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2844AJ [0,0,0,0,0,0|3,0,0]=3 36 B10R1.13 N=C(N)C1=CC=C(N)C=C1 W8418 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.13 NC(=O)C1=NC=C(N)C=N1 8288AB [0,0,0,0,0,0|4,0,0]=4 38 B10R1.13 NC(=O)C1=NN=C(O)C=C1 6449AJ [0,0,0,0,0,0|4,0,0]=4 39 B10R1.13 NC(=S)C1=CN=C(Cl)C=C1 3526AJ [0,0,0,0,0,0|3,1,0]=4 40 B10R1.13 NC(=S)C1=CN=C(N)C=C1 7552AB [0,0,0,0,0,0|3,1,0]=4 41 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [0,0,0,0,0,0|3,0,0]=3 42 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 7653AF [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 NC1=CN=C(C(=O)O)N=C1 Z4892 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.13 O=C(O)C1=CN=C(O)N=C1 W5910 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.13 O=C([O-])C1=NN=C(Cl)C=C1 Y4602 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [0,0,0,0,0,0|3,0,0]=3 48 B10R1.13 O=[N+]([O-])C1=NC=C(O)C=C1 W3318 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [0,0,0,0,0,0|3,0,0]=3 50 B9R1.1 C#CC1=CC=C(I)C=C1 1951AC [1,0,0,0,0,0|1,0,2]=4 51 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [1,0,0,0,0,0|2,0,1]=4 52 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [1,0,0,0,0,0|2,0,0]=3 53 B9R1.1 CC1=CN=C(NN)C=C1 6685AB [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [1,0,0,0,0,0|0,0,1]=2 56 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [1,0,0,0,0,0|2,0,1]=4 57 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [1,0,0,0,0,0|2,0,1]=4 58 B9R1.1 CCC1=CC=C(S)C=C1 S243 [1,0,0,0,0,0|1,0,1]=3 59 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [1,0,0,0,0,0|2,0,1]=4 60 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.1 CNC1=CC=C(N)C=C1 F921 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.1 CNC1=NC=C(N)C=C1 2702AB [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 CSC1=CC=C(S)C=C1 U208 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.1 CSC1=NC=C(C)C=N1 Z2994 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [1,0,0,0,0,0|1,0,2]=4 69 B9R1.1 N#[N+]C1=CC=C(Br)C=C1 6428AL [1,0,0,0,0,0|3,0,0]=4 70 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [1,0,0,0,0,0|3,0,0]=4 71 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [1,0,0,0,0,0|2,0,0]=3 72 B9R1.1 O=CC1=NC=C(Br)C=N1 6187AC [1,0,0,0,0,0|3,0,0]=4 73 B9R1.1 O=CC1=NC=C(F)C=N1 3220AJ [1,0,0,0,0,0|3,0,0]=4 74 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,0,0,0,0,0|1,0,1]=3 75 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [1,0,0,0,0,0|3,0,0]=4 76 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [1,0,0,0,0,0|3,0,0]=4 77 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,0,0,0,0,0|2,0,0]=3 78 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,0,0,0,0,0|2,0,0]=3 79 B9R1.6 CS(=O)C1=NC=CC=N1 7770AJ [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [1,0,0,0,0,0|2,0,1]=4 81 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [1,0,0,0,0,0|2,0,1]=4 82 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [1,0,0,0,0,0|2,0,1]=4 83 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [1,0,0,0,0,0|2,0,0]=3 86 B9R1.6 NC(=O)C1=CC=NN=C1 Z3384 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [1,0,0,0,0,0|2,0,0]=3 88 B9R1.6 NC(=O)C1=NC=CC=N1 Z3390 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.6 O=C(O)C1C=CCC=C1 Y5447 [1,0,0,0,0,0|1,0,2]=4 90 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [1,0,0,0,0,0|2,0,0]=3 91 B9R1.6 O=C([O-])C1=CC=NC=N1 2020AH [1,0,0,0,0,0|3,0,0]=4 92 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [1,0,0,0,0,0|2,0,0]=3 93 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [0,1,0,0,0,0|0,0,0]=1 94 B11R1.3 CC(=O)C1=CN=C(C#N)C=N1 5435AC [0,1,0,0,0,0|2,0,1]=4 95 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [0,1,0,0,0,0|1,0,1]=3 96 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [0,1,0,0,0,0|1,0,1]=3 97 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 3415AB [0,1,0,0,0,0|3,0,0]=4 98 B11R1.3 CN(C)C1=NC=C(CN)C=C1 V5451 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [0,1,0,0,0,0|1,0,1]=3 100 B11R1.3 COC1=CN=C(C(N)=O)C=C1 V8588 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.3 COC1=NC=C(C(=O)O)C=N1 Z0528 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [0,1,0,0,0,0|1,0,0]=2 103 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 W4398 [0,1,0,0,0,0|1,0,2]=4 104 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [0,1,0,0,0,0|1,0,0]=2 105 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 2161AC [0,1,0,0,0,0|2,0,0]=3 106 B11R1.3 O=[N+]([O-])C1=CC=C(CS)C=C1 0403AQ [0,1,0,0,0,0|2,0,0]=3 107 B11R1.3 OB(O)C1=CC=C(CCl)C=C1 X0562 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.3 [C@@H](C)(N)C1=CC=C(C#N)C=C1 0683AP [0,1,0,0,0,0|1,0,2]=4 109 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [0,1,0,0,0,0|2,0,1]=4 111 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [0,1,0,0,0,0|1,0,2]=4 112 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [0,1,0,0,0,0|2,0,1]=4 113 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 0487AB [0,1,0,0,0,0|2,0,0]=3 114 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3478AC [0,1,0,0,0,0|2,0,0]=3 115 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3773AA [0,1,0,0,0,0|2,0,0]=3 116 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5422AL [0,1,0,0,0,0|2,0,0]=3 117 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5497AL [0,1,0,0,0,0|2,0,0]=3 118 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X3142 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 0063AQ [0,1,0,0,0,0|2,0,0]=3 120 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 5137AJ [0,1,0,0,0,0|2,0,0]=3 121 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=C1 Y4885 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.19 CS(=O)(=O)C1=NC=C(N)C=C1 6291AD [0,1,0,0,0,0|3,0,0]=4 123 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 1626AL [0,1,0,0,0,0|2,1,0]=4 124 B11R1.19 O=S(=O)(F)C1=CC=C(F)C=C1 N508 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.19 O=S(=O)([O-])C1=CC=C(Br)C=C1 L660 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.19 O=S(=O)([O-])C1=CC=C(Cl)C=C1 L693 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.19 O=[As](O)(O)C1=CC=C(O)C=C1 7666AF [0,1,0,0,0,0|3,0,0]=4 128 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [0,1,0,0,0,0|1,0,0]=2 129 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [0,1,0,0,0,0|1,0,0]=2 130 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [0,1,0,0,0,0|1,0,0]=2 131 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,1,0,0,0,0|0,0,0]=1 132 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.21 CC(=O)C1=CN=C(C)C(C)=N1 7817AB [0,1,0,0,0,0|2,0,0]=3 134 B11R1.21 CC(C)C1=CC(Br)=C(O)C=C1 6556AD [0,1,0,0,0,0|2,0,1]=4 135 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 7727AC [0,1,0,0,0,0|2,0,1]=4 136 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 V8866 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [0,1,0,0,0,0|1,0,2]=4 138 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [0,1,0,0,0,0|1,0,1]=3 139 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [0,1,0,0,0,0|1,1,0]=3 140 B11R1.21 CC1=C(C)N=C(C(N)=O)C=N1 4144AB [0,1,0,0,0,0|3,0,0]=4 141 B11R1.21 CC1=C(Cl)N=CC(C(N)=O)=C1 7444AE [0,1,0,0,0,0|3,0,0]=4 142 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 5832AD [0,1,0,0,0,0|1,1,0]=3 143 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [0,1,0,0,0,0|2,0,1]=4 144 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3798AA [0,1,0,0,0,0|2,0,1]=4 145 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3799AA [0,1,0,0,0,0|2,0,1]=4 146 B11R1.21 CC1=CC(C(=O)O)=CNC1=O 0272AC [0,1,0,0,0,0|3,0,0]=4 147 B11R1.21 CC1=CC(N(C)C)=CC=C1N 1607AB [0,1,0,0,0,0|3,0,0]=4 148 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Z0083 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [0,1,0,0,0,0|2,0,0]=3 150 B11R1.21 CC1=CC=C(C(=O)O)N=C1C 2856AC [0,1,0,0,0,0|2,0,0]=3 151 B11R1.21 CC1=CC=C(C(=O)O)NC1=O 2494AA [0,1,0,0,0,0|2,0,0]=3 152 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [0,1,0,0,0,0|1,0,1]=3 153 B11R1.21 CC1=CC=C(C(F)F)C=C1F 1136AD [0,1,0,0,0,0|2,0,1]=4 154 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [0,1,0,0,0,0|1,0,1]=3 155 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br Y3916 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [0,1,0,0,0,0|2,0,1]=4 157 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 1180AL [0,1,0,0,0,0|2,0,1]=4 158 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 4775AA [0,1,0,0,0,0|2,0,1]=4 159 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 X9639 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 W5394 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 7502AA [0,1,0,0,0,0|2,0,1]=4 162 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 2069AA [0,1,0,0,0,0|2,0,1]=4 163 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 2235AJ [0,1,0,0,0,0|3,0,0]=4 166 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 5315AH [0,1,0,0,0,0|3,0,0]=4 167 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 Y4731 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 2075AJ [0,1,0,0,0,0|3,0,0]=4 169 B11R1.21 NC(=O)C1=CC(N)=C(F)C=C1 6127AC [0,1,0,0,0,0|2,0,0]=3 170 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [0,1,0,0,0,0|2,0,0]=3 171 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 Z8676 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 V7781 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [0,1,0,0,0,0|2,0,0]=3 174 B11R1.21 NC(=O)C1=CC=C(N)C(N)=C1 8382AE [0,1,0,0,0,0|2,0,0]=3 175 B11R1.21 NC(=O)C1=CN=C(Cl)C(Cl)=C1 9219AE [0,1,0,0,0,0|3,0,0]=4 176 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 5309AE [0,1,0,0,0,0|3,0,0]=4 177 B11R1.21 NC1=C(I)C=CC([N+](=O)[O-])=C1 7907AB [0,1,0,0,0,0|3,0,0]=4 178 B11R1.21 NC1=CC(C(=O)O)=CC=C1F V5597 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.21 NC1=CC(C(=O)O)=CC=C1O D461 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.21 O=C(O)C1=CC(=O)C(O)=CO1 0899AQ [0,1,0,0,0,0|3,0,0]=4 181 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 X3304 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.21 O=C(O)C1=CC(Cl)=C(F)N=C1 4922AB [0,1,0,0,0,0|3,0,0]=4 183 B11R1.21 O=C(O)C1=CC(F)=C(F)N=C1 Y4245 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 1126AD [0,1,0,0,0,0|3,0,0]=4 185 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 X6546 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 Y6596 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 Y4247 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 1343AA [0,1,0,0,0,0|3,0,0]=4 189 B11R1.21 O=C([O-])C1=CC=C(F)C(F)=C1 3820AL [0,1,0,0,0,0|2,0,0]=3 190 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,1,0,0,0,0|1,0,1]=3 191 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [0,1,0,0,0,0|2,0,1]=4 192 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [0,1,0,0,0,0|0,0,0]=1 193 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,1,0,0,0,0|0,0,2]=3 194 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,1,0,0,0,0|0,0,2]=3 195 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,1,0,0,0,0|1,0,0]=2 196 B11R1.22 CC1=CN=C(C(=O)NN)C=N1 1913AE [0,1,0,0,0,0|3,0,0]=4 197 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [0,1,0,0,0,0|1,0,0]=2 198 B11R1.22 CCC(=O)C1=NC=C(Br)C=N1 Y3142 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [0,1,0,0,0,0|2,0,1]=4 200 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,1,0,0,0,0|1,0,1]=3 201 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [0,1,0,0,0,0|2,0,1]=4 202 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [0,1,0,0,0,0|2,0,1]=4 203 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,1,0,0,0,0|1,0,2]=4 204 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,1,0,0,0,0|2,0,0]=3 205 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,1,0,0,0,0|1,0,1]=3 206 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 2642AB [0,1,0,0,0,0|1,0,0]=2 209 B11R1.22 CNC(=O)C1=CN=C(Cl)N=C1 6428AA [0,1,0,0,0,0|3,0,0]=4 210 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [0,1,0,0,0,0|2,0,1]=4 211 B11R1.22 COC(=O)C1=CC=C(N)C=C1 3562AL [0,1,0,0,0,0|1,0,0]=2 212 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,1,0,0,0,0|2,0,0]=3 213 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 W5141 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.22 COC(=O)C1=CN=C(I)C=C1 V3781 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.22 COC(=O)C1=CNC(=O)N=C1 6987AB [0,1,0,0,0,0|3,0,0]=4 216 B11R1.22 COC(=O)C1=NC=C(F)C=N1 7118AJ [0,1,0,0,0,0|3,0,0]=4 217 B11R1.22 COC(=O)C1=NC=C(N)C=N1 3573AL [0,1,0,0,0,0|3,0,0]=4 218 B11R1.22 COC(=O)C1=NN=C(C)C=C1 8321AC [0,1,0,0,0,0|2,0,0]=3 219 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,1,0,0,0,0|1,0,2]=4 220 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [0,1,0,0,0,0|1,0,1]=3 221 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [0,1,0,0,0,0|2,0,1]=4 222 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 2661AL [0,1,0,0,0,0|1,0,1]=3 223 B11R1.22 N#CC(=O)C1=CC=C(F)C=C1 7543AE [0,1,0,0,0,0|1,0,1]=3 224 B11R1.22 N=C(NO)C1=CC=C(Br)C=C1 9499AJ [0,1,0,0,0,0|2,0,1]=4 225 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,1,0,0,0,0|1,0,0]=2 226 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,1,0,0,0,0|1,0,0]=2 227 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,1,0,0,0,0|1,0,2]=4 228 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,1,0,0,0,0|1,0,2]=4 229 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,1,0,0,0,0|1,0,2]=4 230 B11R1.22 NNC(=O)C1=CC=C(Cl)C=N1 7212AA [0,1,0,0,0,0|3,0,0]=4 231 B11R1.22 NNC(=O)C1=CN=C(N)C=C1 Z3023 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 Z4030 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.22 NNC(=O)C1=NC=C(O)C=C1 Z2983 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 W6566 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 W7901 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.22 O=C(CBr)C1=CC=C(Br)N=C1 Y6042 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.22 O=C(CBr)C1=CN=C(Cl)N=C1 0273AA [0,1,0,0,0,0|3,0,0]=4 238 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 7216AA [0,1,0,0,0,0|2,0,0]=3 239 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 Y4820 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,1,0,0,0,0|1,0,0]=2 241 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 3895AB [0,1,0,0,0,0|1,0,0]=2 243 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,1,0,0,0,0|1,0,0]=2 244 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 A977 [0,1,0,0,0,0|1,0,1]=3 245 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,1,0,0,0,0|1,0,1]=3 246 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 W4184 [0,1,0,0,0,0|1,0,1]=3 247 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,1,0,0,0,0|2,0,1]=4 248 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [0,1,0,0,0,0|1,0,2]=4 249 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,1,0,0,0,0|1,0,2]=4 250 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 9497AJ [0,1,0,0,0,0|2,0,1]=4 251 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 2731AB [0,1,0,0,0,0|2,0,1]=4 252 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [0,1,0,0,0,0|0,0,0]=1 253 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [0,1,0,0,0,0|1,0,0]=2 254 B11R1.166 CC(=O)C1=CC=C(Br)C=C1N X9573 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 2069AF [0,1,0,0,0,0|2,0,0]=3 256 B11R1.166 CC(=O)C1=CNC(=O)N=C1C X9048 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F Z7758 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Cl 6873AA [0,1,0,0,0,0|2,0,0]=3 259 B11R1.166 CC1=C(C(=N)N)C=CC(Cl)=C1 1883AF [0,1,0,0,0,0|3,0,0]=4 260 B11R1.166 CC1=C(C(N)=S)C=CC(Cl)=C1 8169AD [0,1,0,0,0,0|2,1,0]=4 261 B11R1.166 CC1=C(N(C)C)C=CC(N)=C1 9005AD [0,1,0,0,0,0|3,0,0]=4 262 B11R1.166 CC1=CC(Br)=CC=C1N(C)C V6277 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O V3028 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 1357AA [0,1,0,0,0,0|2,0,0]=3 265 B11R1.166 CC1=CC(N)=C(C(N)=O)N=C1 1002AD [0,1,0,0,0,0|2,0,0]=3 266 B11R1.166 CC1=CC(N)=C(N(C)C)C=C1 6144AD [0,1,0,0,0,0|2,0,0]=3 267 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 1620AJ [0,1,0,0,0,0|2,0,0]=3 268 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 Z5384 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.166 CC1=NC(N)=CC=C1C(=O)O 0478AC [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 CC1=NC=C(C(=O)O)C(=O)N1 6219AD [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 5812AC [0,1,0,0,0,0|3,0,0]=4 272 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 X9715 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.166 CN(C)C1=C(F)C=C(N)C=C1 2086AE [0,1,0,0,0,0|3,0,0]=4 274 B11R1.166 CN(C)C1=C(N)C=C(F)C=C1 6145AD [0,1,0,0,0,0|3,0,0]=4 275 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl 6600AE [0,1,0,0,0,0|3,0,0]=4 276 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 1178AL [0,1,0,0,0,0|2,0,1]=4 277 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 2379AC [0,1,0,0,0,0|2,0,1]=4 278 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8708 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8720 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 2690AJ [0,1,0,0,0,0|3,0,0]=4 281 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F 3281AH [0,1,0,0,0,0|3,0,0]=4 282 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 1384AJ [0,1,0,0,0,0|3,0,0]=4 283 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1F 5593AH [0,1,0,0,0,0|3,0,0]=4 284 B11R1.166 N=C(N)C1=CC=C(F)C=C1Cl 5020AH [0,1,0,0,0,0|3,0,0]=4 285 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=N1 2582AB [0,1,0,0,0,0|3,0,0]=4 286 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 4852AB [0,1,0,0,0,0|2,0,0]=3 287 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl V5905 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.166 NC(=O)C1=CN=C(O)C=C1O 6041AJ [0,1,0,0,0,0|3,0,0]=4 289 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O 7647AB [0,1,0,0,0,0|3,0,0]=4 290 B11R1.166 NC1=CC(O)=NC=C1C(=O)O Z5190 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Z0711 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.166 O=C(O)C1=C(Cl)N=C(F)C=C1 3712AA [0,1,0,0,0,0|3,0,0]=4 293 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 3121AC [0,1,0,0,0,0|3,0,0]=4 294 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl 1385AA [0,1,0,0,0,0|3,0,0]=4 295 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br 1384AA [0,1,0,0,0,0|3,0,0]=4 296 B11R1.166 O=C(O)C1=CC=C(I)C=C1O 8615AA [0,1,0,0,0,0|2,0,0]=3 297 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F Y8203 [0,1,0,0,0,0|3,0,0]=4 298 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [0,0,0,1,0,0|1,0,2]=4 299 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [0,0,0,1,0,0|1,0,2]=4 300 B11R2.34 FC1=CC=C(C2CO2)C=C1 0449AQ [0,0,0,1,0,0|1,0,2]=4 301 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [0,0,0,0,1,0|2,0,0]=3 302 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [0,0,0,0,1,0|2,0,0]=3 303 B9R1.35 CC(=O)C1=NC(C)=CN1 2011AB [0,0,0,0,1,0|2,0,0]=3 304 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [0,0,0,0,1,0|2,0,0]=3 305 B9R1.35 CC(=O)C1=NC=C(Br)S1 2132AC [0,0,0,0,1,0|3,0,0]=4 306 B9R1.35 CC1=CC(C(=O)O)=CN1 X8465 [0,0,0,0,1,0|2,0,0]=3 307 B9R1.35 CC1=CC(C(N)=O)=NN1 Z2991 [0,0,0,0,1,0|3,0,0]=4 308 B9R1.35 CC1=CC=C(C(=O)O)N1 4808AB [0,0,0,0,1,0|2,0,0]=3 309 B9R1.35 CC1=CN=C(C(=O)O)O1 X6429 [0,0,0,0,1,0|3,0,0]=4 310 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [0,0,0,0,1,0|2,0,0]=3 311 B9R1.35 CC1=CNC(C(=O)O)=N1 Y9876 [0,0,0,0,1,0|3,0,0]=4 312 B9R1.35 CC1=COC(C(=O)O)=N1 X6324 [0,0,0,0,1,0|3,0,0]=4 313 B9R1.35 CC1=NC(C(N)=O)=CO1 X5248 [0,0,0,0,1,0|3,0,0]=4 314 B9R1.35 CC1=NC(C(N)=O)=CS1 Y5140 [0,0,0,0,1,0|3,0,0]=4 315 B9R1.35 NC(=O)C1=CC=C(Br)N1 9191AA [0,0,0,0,1,0|3,0,0]=4 316 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [0,0,0,0,1,0|3,0,0]=4 317 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [0,0,0,0,1,0|3,0,0]=4 318 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [0,0,0,0,1,0|3,0,0]=4 319 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 Y8599 [0,0,0,0,0,1|2,0,0]=3 320 B11R1.20 CC(=O)NC1=CC=C(O)C=N1 8000AA [0,0,0,0,0,1|2,0,0]=3 321 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,0,0,0,0,1|2,0,0]=3 322 B11R1.20 CC(=O)NC1=NC=C(Br)C=N1 V3896 [0,0,0,0,0,1|3,0,0]=4 323 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,0,0,0,0,1|1,0,0]=2 324 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [0,0,0,0,0,1|1,0,0]=2 325 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [0,0,0,0,0,1|2,0,1]=4 326 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [0,0,0,0,0,1|2,0,1]=4 327 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,0,0,0,0,1|2,0,0]=3 328 B11R1.20 CC1=CC=C(N=C(N)N)C=C1 7745AB [0,0,0,0,0,1|2,0,0]=3 329 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,0,0,0,0,1|2,0,0]=3 330 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [0,0,0,0,0,1|1,0,0]=2 331 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [0,0,0,0,0,1|1,0,1]=3 332 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 W8749 [0,0,0,0,0,1|2,0,0]=3 333 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 6320AE [0,0,0,0,0,1|3,0,0]=4 334 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,0,0,0,0,1|3,0,0]=4 335 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [0,0,0,0,0,1|2,0,0]=3 336 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,0,0,0,0,1|2,0,0]=3 337 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 4488AD [0,0,0,0,0,1|2,1,0]=4 338 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,0,0,0,0,1|3,0,0]=4 339 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 6322AB [0,0,0,0,0,1|3,0,0]=4 340 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [0,0,0,0,0,1|3,0,0]=4 341 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [0,0,0,0,0,1|3,0,0]=4 342 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 3963AE [0,0,0,0,0,1|3,0,0]=4 343 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 6457AL [0,0,0,0,0,1|2,1,0]=4 344 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [2,0,0,0,0,0|2,0,0]=4 345 B8R1.2 CC[N+]1=CC=CC=C1 E438 [2,0,0,0,0,0|1,0,1]=4 346 B8R1.2 NCC1=CC=CC=C1 7149AL [2,0,0,0,0,0|1,0,1]=4 347 B8R1.2 NOC1=CC=CC=C1 X4801 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.2 O=CC1=CN=NC=C1 7044AB [2,0,0,0,0,0|2,0,0]=4 349 B8R1.2 O=CC1=NC=CC=N1 Y3220 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [2,0,0,0,0,0|1,0,0]=3 351 B8R1.2 ONC1=CC=CC=C1 0019AQ [2,0,0,0,0,0|1,0,1]=4 352 B8R1.3 CC1=CN=C(C)N=C1 1431AB [2,0,0,0,0,0|2,0,0]=4 353 B8R1.3 CC1=CN=C(I)C=C1 5573AJ [2,0,0,0,0,0|2,0,0]=4 354 B10R1.1 C=CCC1=CC=C(C)C=C1 1127AQ [1,1,0,0,0,0|0,0,1]=3 355 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [1,1,0,0,0,0|1,0,1]=4 356 B10R1.1 C=COC1=CC=C(Br)C=C1 Y3507 [1,1,0,0,0,0|1,0,1]=4 357 B10R1.1 CC1=CC=C(CNN)C=C1 8497AC [1,1,0,0,0,0|1,0,1]=4 358 B10R1.1 CC1=CC=C(N=[N+]=[N-])C=C1 0054AQ [1,1,0,0,0,0|2,0,0]=4 359 B10R1.1 CC1=CC=C(SCCl)C=C1 7374AL [1,1,0,0,0,0|1,0,0]=3 360 B10R1.1 CC1=NC=C(CCO)C=C1 0118AA [1,1,0,0,0,0|1,0,1]=4 361 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [1,1,0,0,0,0|0,0,1]=3 362 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [1,1,0,0,0,0|1,0,1]=4 363 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [1,1,0,0,0,0|1,0,1]=4 364 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [1,1,0,0,0,0|1,0,1]=4 365 B10R1.1 CNCC1=CC=C(N)C=C1 Q169 [1,1,0,0,0,0|1,0,1]=4 366 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [1,1,0,0,0,0|1,0,1]=4 367 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [1,1,0,0,0,0|1,0,1]=4 368 B10R1.1 O=CNC1=CC=C(Br)C=C1 1242AQ [1,1,0,0,0,0|1,0,0]=3 369 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 4986AB [1,1,0,0,0,0|1,0,1]=4 370 B10R1.1 O\N=C\C1=CC=C(O)C=C1 6494AE [1,1,0,0,0,0|1,0,1]=4 371 B10R1.3 C#CC1=CC=C(CN)C=C1 0181AB [1,1,0,0,0,0|0,0,2]=4 372 B10R1.3 C=CC1=CC=C(C#N)C=C1 8141AJ [1,1,0,0,0,0|0,0,2]=4 373 B10R1.3 CCC1=CC=C(CBr)C=C1 9519AH [1,1,0,0,0,0|0,0,1]=3 374 B10R1.3 CCC1=CC=C(CN)C=C1 9087AE [1,1,0,0,0,0|0,0,1]=3 375 B10R1.3 CCC1=CC=C(NN)C=C1 8775AH [1,1,0,0,0,0|1,0,1]=4 376 B10R1.3 COC1=CC=C(CN)C=N1 V4770 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.3 COC1=CN=C(CCl)C=C1 2740AC [1,1,0,0,0,0|2,0,0]=4 378 B10R1.3 COC1=CN=C(OC)C=C1 Z0918 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.3 COC1=NC=C(CBr)C=C1 Y7368 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.3 COC1=NC=C(CCl)C=C1 3509AA [1,1,0,0,0,0|2,0,0]=4 381 B10R1.3 CSC1=CC=C(NN)C=C1 1474AE [1,1,0,0,0,0|2,0,0]=4 382 B10R1.3 CSC1=NC=C(C=O)C=C1 Z0204 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.3 N#CC1=CN=C(C=O)C=C1 W4334 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.3 NCC1=CC=C(CBr)C=C1 4131AB [1,1,0,0,0,0|1,0,1]=4 385 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 7787AC [1,1,0,0,0,0|1,0,1]=4 386 B10R1.25 CC1=C(C=O)C=CC(N)=N1 3414AJ [1,1,0,0,0,0|2,0,0]=4 387 B10R1.25 CC1=C(C=O)C=NC(Br)=C1 5663AC [1,1,0,0,0,0|2,0,0]=4 388 B10R1.25 CC1=CC(Br)=NC=C1C=O Z0096 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 CC1=CC=C(NN)C(C)=C1 1053AL [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 CC1=CC=C(NN)C(Cl)=C1 Y4636 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.25 CC1=CC=C(NN)C(F)=C1 8500AH [1,1,0,0,0,0|2,0,0]=4 392 B10R1.25 CC1=NC(Br)=CC=C1C=O Y4718 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.25 CC1=NC(F)=CC=C1C=O Z0986 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.25 CCC1=C(Br)C=C(N)C=C1 5299AH [1,1,0,0,0,0|1,0,1]=4 395 B10R1.25 CCC1=C(N)C=C(C)N=C1 7618AB [1,1,0,0,0,0|1,0,1]=4 396 B10R1.25 CCC1=CC=C(Br)C=C1N 3118AJ [1,1,0,0,0,0|1,0,1]=4 397 B10R1.25 CCC1=CC=C(C)C=C1C Y1729 [1,1,0,0,0,0|0,0,1]=3 398 B10R1.25 CCC1=CC=C(C)N=C1N X4575 [1,1,0,0,0,0|1,0,1]=4 399 B10R1.25 CNC1=C(Br)C=C(Br)C=C1 1026AQ [1,1,0,0,0,0|2,0,0]=4 400 B10R1.25 CNC1=C(N)C=C(Cl)C=C1 2669AL [1,1,0,0,0,0|2,0,0]=4 401 B10R1.25 CNC1=CC=C(Cl)C=C1Br Z8181 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.25 CNC1=CC=C(F)C=C1Br Z8432 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.25 CNC1=CC=C(F)C=C1F Z7994 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.25 COC1=C(Cl)C=C(C)C=C1 7494AD [1,1,0,0,0,0|1,0,0]=3 405 B10R1.25 COC1=CC=C(Br)C=C1N Z7000 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.25 COC1=CC=C(C)C=C1F Z0570 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.25 COC1=CC=C(I)C=C1Cl Z0832 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.25 COC1=CC=C(N)C=C1C 0301AD [1,1,0,0,0,0|2,0,0]=4 409 B10R1.25 COC1=NC=C(C)C=C1Cl W9916 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.25 COC1=NC=C(C)C=C1I Z8220 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.25 COC1=NC=C(C)C=C1O Z8657 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.25 CSC1=CC=C(Cl)C=C1Br Z0606 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 8691AB [1,1,0,0,0,0|2,0,0]=4 414 B10R1.25 O=CC1=C(Br)N=C(Cl)C=C1 1383AA [1,1,0,0,0,0|2,0,0]=4 415 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 Z3894 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.25 O=CC1=CN=C(Br)C=C1Br 3733AA [1,1,0,0,0,0|2,0,0]=4 417 B10R1.25 O=CC1=CN=C(Br)C=C1Cl 1371AA [1,1,0,0,0,0|2,0,0]=4 418 B10R1.25 O=CC1=CN=C(Cl)C=C1Br 1353AA [1,1,0,0,0,0|2,0,0]=4 419 B10R1.25 O=CC1=CN=C(F)C=C1Cl 4845AA [1,1,0,0,0,0|2,0,0]=4 420 B10R1.25 O=CC1=NC=C(Br)C=C1Br 4900AC [1,1,0,0,0,0|2,0,0]=4 421 B10R1.25 O=CC1=NC=C(Cl)C=C1Cl W6408 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 2176AB [1,1,0,0,0,0|1,0,1]=4 423 B10R1.176 CC1=C(F)C=C(CBr)C=C1 7166AA [1,1,0,0,0,0|1,0,1]=4 424 B10R1.176 CC1=CC(C=O)=CN=C1Br Z0993 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.176 CC1=CC=C(C=O)C=C1O Z0696 [1,1,0,0,0,0|0,0,0]=2 426 B10R1.176 CC1=NC(C=O)=CC=C1Br Z0161 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.176 CC1=NC(C=O)=CC=C1F 4137AC [1,1,0,0,0,0|2,0,0]=4 428 B10R1.176 CCC1=CC(C)=C(C)C=C1 6497AL [1,1,0,0,0,0|0,0,1]=3 429 B10R1.176 CCC1=CC(F)=C(N)C=C1 2714AC [1,1,0,0,0,0|1,0,1]=4 430 B10R1.176 CCC1=CC(F)=C(N)C=C1 3498AA [1,1,0,0,0,0|1,0,1]=4 431 B10R1.176 CCC1=CC(N)=C(F)C=C1 7951AA [1,1,0,0,0,0|1,0,1]=4 432 B10R1.176 CCC1=CC(N)=C(N)C=C1 2716AA [1,1,0,0,0,0|1,0,1]=4 433 B10R1.176 CNC1=CC=C(C)C(Br)=C1 2220AJ [1,1,0,0,0,0|1,0,0]=3 434 B10R1.176 CNC1=CC=C(C)C(Cl)=C1 V7723 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.176 CNC1=CC=C(Cl)C(Cl)=C1 Z7949 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.176 COC1=CC=C(N)C(C)=C1 Z9736 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.176 COC1=CN=C(C)C(Br)=C1 X3672 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.176 CSC1=CC=C(Br)C(C)=C1 Z1061 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.176 CSC1=CC=C(Br)C(F)=C1 Z1097 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.176 O=CC1=CC(Br)=C(Cl)N=C1 8633AE [1,1,0,0,0,0|2,0,0]=4 441 B10R1.176 O=CC1=CC=C(F)C(I)=C1 W4645 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.176 O=CC1=CC=C(I)C(F)=C1 X8505 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.176 O=CC1=CC=C(O)C(I)=C1 X5653 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.15 C#CC(=O)C1=CC=CC=C1 0047AQ [1,1,0,0,0,0|0,0,1]=3 445 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [1,1,0,0,0,0|1,0,0]=3 447 B10R1.15 CCC(=O)C1=NC=CN=C1 7151AB [1,1,0,0,0,0|2,0,0]=4 448 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [1,1,0,0,0,0|1,0,1]=4 449 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [1,1,0,0,0,0|1,0,1]=4 450 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [1,1,0,0,0,0|1,0,0]=3 451 B10R1.15 COC(=O)N1C=CC=CC1 3960AB [1,1,0,0,0,0|1,0,1]=4 452 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [1,1,0,0,0,0|0,0,2]=4 453 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [1,1,0,0,0,0|1,0,0]=3 454 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [1,1,0,0,0,0|1,0,1]=4 455 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [1,1,0,0,0,0|1,0,1]=4 456 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [1,1,0,0,0,0|1,0,0]=3 457 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [1,1,0,0,0,0|1,0,1]=4 458 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [1,1,0,0,0,0|1,0,0]=3 459 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [1,1,0,0,0,0|1,0,0]=3 460 B10R1.15 O=C(CBr)C1=NC=CN=C1 Z2340 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.15 O=C(CCl)C1=CC=NC=C1 5498AJ [1,1,0,0,0,0|1,0,0]=3 462 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [1,1,0,0,0,0|1,0,0]=3 463 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [1,1,0,0,0,0|0,0,2]=4 464 B10R1.28 CS(=O)(=O)C1=NC=CC=C1 Y7797 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 Z8042 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 5121AF [1,1,0,0,0,0|2,0,0]=4 467 B10R1.61 C=C(C)C1=C(C)C=CC=C1 5671AL [1,1,0,0,0,0|1,0,0]=3 468 B10R1.61 CC(=O)C1=C(O)C=NC=C1 Z4577 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.61 CC(=O)C1=CC=CNC1=O W7482 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.61 CC(=O)C1=NC=CC=C1Cl 5776AA [1,1,0,0,0,0|1,0,0]=3 471 B10R1.61 CC(=O)C1=NC=CC=C1O Z4085 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.61 CC(Br)C1=CC=CC=C1F Y9030 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.61 CC(N)C1=CC=CC=C1Br Z7493 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 6296AA [1,1,0,0,0,0|0,0,2]=4 475 B10R1.61 CC1=C(C(=O)O)N=CC=C1 4521AA [1,1,0,0,0,0|2,0,0]=4 476 B10R1.61 CC1=C(C(C)C)C=CC=C1 8715AL [1,1,0,0,0,0|1,0,1]=4 477 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 3317AC [1,1,0,0,0,0|1,0,1]=4 478 B10R1.61 CC1=CC=CN=C1C(N)=O 3720AF [1,1,0,0,0,0|2,0,0]=4 479 B10R1.61 CS(=O)C1=CC=CC=C1Br 8910AE [1,1,0,0,0,0|1,0,0]=3 480 B10R1.61 CS(=O)C1=CC=CC=C1O Z7171 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 8346AH [1,1,0,0,0,0|1,0,1]=4 482 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br 2344AA [1,1,0,0,0,0|1,0,1]=4 483 B10R1.61 C[C@@H](N)C1=CC=CC=C1F X9177 [1,1,0,0,0,0|1,0,1]=4 484 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 N446 [1,1,0,0,0,0|0,0,2]=4 485 B10R1.61 C[C@H](N)C1=CC=CC=C1Br Z4151 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 8791AA [1,1,0,0,0,0|0,0,2]=4 487 B10R1.61 C[C@H](O)C1=CC=CC=C1Br N448 [1,1,0,0,0,0|0,0,2]=4 488 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 1622AJ [1,1,0,0,0,0|2,0,0]=4 489 B10R1.61 N=C(N)C1=CC=CC=C1F 1049AC [1,1,0,0,0,0|2,0,0]=4 490 B10R1.61 NC(=O)C1=C(Br)N=CC=C1 W9002 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.61 NC(=O)C1=C(Cl)C=CN=C1 Y3257 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.61 NC(=S)C1=CC=CC=C1Br 1055AQ [1,1,0,0,0,0|1,1,0]=4 493 B10R1.61 O=C(O)C1=C(I)C=NC=C1 Y5476 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 W6093 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.113 CC(=O)C1=CC(C)=NC=N1 W7770 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.113 CC(=O)C1=CC(F)=CN=C1 3535AA [1,1,0,0,0,0|1,0,0]=3 497 B10R1.113 CC(=O)C1=NC(F)=CC=C1 6832AB [1,1,0,0,0,0|1,0,0]=3 498 B10R1.113 CC(=O)C1=NC(N)=NC=C1 8301AC [1,1,0,0,0,0|2,0,0]=4 499 B10R1.113 CC(N)C1=CC(O)=CC=C1 Y9690 [1,1,0,0,0,0|1,0,1]=4 500 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V5733 [1,1,0,0,0,0|1,0,1]=4 501 B10R1.113 CC1=CC(C(=N)N)=CC=C1 2354AJ [1,1,0,0,0,0|2,0,0]=4 502 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [1,1,0,0,0,0|2,0,0]=4 503 B10R1.113 CC1=CC=CC(C(C)C)=C1 5135AE [1,1,0,0,0,0|1,0,1]=4 504 B10R1.113 CN(C)C1=CC=CC(N)=C1 2773AB [1,1,0,0,0,0|2,0,0]=4 505 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 W5401 [1,1,0,0,0,0|1,0,1]=4 506 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 Z5107 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 3482AA [1,1,0,0,0,0|0,0,2]=4 508 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 5245AA [1,1,0,0,0,0|0,0,2]=4 509 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 W5400 [1,1,0,0,0,0|1,0,1]=4 510 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 6219AA [1,1,0,0,0,0|0,0,2]=4 511 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 5244AA [1,1,0,0,0,0|0,0,2]=4 512 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 7814AH [1,1,0,0,0,0|2,0,0]=4 513 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 2211AJ [1,1,0,0,0,0|2,0,0]=4 514 B10R1.113 NC(=O)C1=NC(F)=CC=C1 V5539 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 Z2563 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.113 O=C(O)C1=CN=CC(I)=C1 Z4205 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.113 O=C([O-])C1=CC(O)=CC=C1 8975AL [1,1,0,0,0,0|1,0,0]=3 519 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 6772AE [1,1,0,0,0,0|2,0,0]=4 520 B10R1.113 O=S([O-])C1=CC=CC(Br)=C1 V8824 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.14 CC1=CC(C(=O)NN)=CS1 4925AE [0,1,0,0,1,0|2,0,0]=4 522 B10R1.14 CC1=CC=C(C(=O)CCl)S1 V5115 [0,1,0,0,1,0|1,0,0]=3 523 B10R1.14 CCC(=O)C1=CC=C(C)S1 6348AE [0,1,0,0,1,0|1,0,0]=3 524 B10R1.14 CN1C=C(C(=O)CBr)C=N1 0965AC [0,1,0,0,1,0|2,0,0]=4 525 B10R1.14 COC(=O)C1=CC(C)=CN1 0966AE [0,1,0,0,1,0|1,0,0]=3 526 B10R1.14 COC(=O)C1=CC(C)=NO1 0210AA [0,1,0,0,1,0|2,0,0]=4 527 B10R1.14 COC(=O)C1=CC(F)=CS1 0106AP [0,1,0,0,1,0|2,0,0]=4 528 B10R1.14 COC(=O)C1=CC=C(Cl)O1 7113AJ [0,1,0,0,1,0|2,0,0]=4 529 B10R1.14 O=C(CCl)C1=CC=C(Cl)S1 1639AJ [0,1,0,0,1,0|2,0,0]=4 530 B10R1.31 C#CC1=CC=C(C(C)=O)S1 0109AC [0,1,0,0,1,0|1,0,1]=4 531 B10R1.31 CC(=O)C1=CC(C=O)=CS1 3015AE [0,1,0,0,1,0|1,0,1]=4 532 B10R1.31 CCC1=CC(C(=O)O)=CS1 Y1108 [0,1,0,0,1,0|2,0,0]=4 533 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 9939AB [0,1,0,0,1,0|2,0,0]=4 534 B10R1.31 CCC1=CC=C(C(=O)O)O1 8236AB [0,1,0,0,1,0|2,0,0]=4 535 B10R1.31 CCC1=CC=C(C(=O)O)S1 Z2977 [0,1,0,0,1,0|2,0,0]=4 536 B10R1.31 CCN1C=C(C(C)=O)C=N1 3333AF [0,1,0,0,1,0|2,0,0]=4 537 B10R1.31 COC1=CC=C(C(=O)O)O1 3836AF [0,1,0,0,1,0|2,0,0]=4 538 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 3393AC [0,1,0,0,1,0|1,0,0]=3 539 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 2990AB [0,1,0,0,1,0|2,0,0]=4 540 B10R1.59 CC(=O)C1=C(Br)SC(Br)=C1 5769AJ [0,1,0,0,1,0|2,0,0]=4 541 B10R1.59 CC(=O)C1=C(C)SC(C)=N1 7416AB [0,1,0,0,1,0|2,0,0]=4 542 B10R1.59 CC(=O)C1=CC(C)=NN1C W8962 [0,1,0,0,1,0|2,0,0]=4 543 B10R1.59 CC(=O)C1=CN(C)N=C1C 4978AE [0,1,0,0,1,0|2,0,0]=4 544 B10R1.59 CC1=CC(C(=O)O)=C(C)S1 Y8498 [0,1,0,0,1,0|2,0,0]=4 545 B10R1.59 CC1=CC(C(=O)O)=C(N)S1 3020AE [0,1,0,0,1,0|2,0,0]=4 546 B10R1.194 CC(=O)C1=C(Br)C(Br)=CS1 5934AE [0,1,0,0,1,0|2,0,0]=4 547 B10R1.194 CC(=O)C1=C(C)N(C)N=C1 7374AD [0,1,0,0,1,0|2,0,0]=4 548 B10R1.194 CC(=O)C1=C(N)N(C)N=C1 0835AF [0,1,0,0,1,0|2,0,0]=4 549 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 6451AD [0,1,0,0,1,0|2,0,0]=4 550 B10R1.194 CC1=CSC(C(=O)O)=C1Cl 7815AD [0,1,0,0,1,0|2,0,0]=4 551 B10R1.194 CC1=CSC(C(=O)O)=C1N 1700AB [0,1,0,0,1,0|2,0,0]=4 552 B12R1.4 C#CC1=CC=C(NC(C)=O)C=C1 4419AB [0,1,0,0,0,1|0,0,1]=3 553 B12R1.4 C=C(Br)CC1=CC=C(SC)C=C1 0379AF [0,1,0,0,0,1|1,0,1]=4 554 B12R1.4 C=C(C)CC1=CC=C(OC)C=C1 7091AD [0,1,0,0,0,1|1,0,0]=3 555 B12R1.4 CC(=O)OC1=CC=C(CCl)C=C1 X4658 [0,1,0,0,0,1|0,0,0]=2 556 B12R1.4 CC(=O)OC1=CC=C(CO)C=C1 1126AQ [0,1,0,0,0,1|0,0,0]=2 557 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 7098AC [0,1,0,0,0,1|1,0,1]=4 558 B12R1.4 CC(C)OC1=CC=C(CO)C=C1 1352AL [0,1,0,0,0,1|1,0,1]=4 559 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 7067AA [0,1,0,0,0,1|1,0,0]=3 560 B12R1.4 CCC1=CC=C(OC(C)=O)C=C1 6985AL [0,1,0,0,0,1|0,0,0]=2 561 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 V5334 [0,1,0,0,0,1|2,0,0]=4 562 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 Z2397 [0,1,0,0,0,1|2,0,0]=4 563 B12R1.4 COC1=CC=C(CC(=O)O)C=N1 V8890 [0,1,0,0,0,1|2,0,0]=4 564 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 0374AC [0,1,0,0,0,1|2,0,0]=4 565 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 X5525 [0,1,0,0,0,1|2,0,0]=4 566 B12R1.4 COC1=CC=C(NC(C)C)C=C1 8375AA [0,1,0,0,0,1|1,0,1]=4 567 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 X9403 [0,1,0,0,0,1|1,0,0]=3 568 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 3012AB [0,1,0,0,0,1|2,0,0]=4 569 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 7496AE [0,1,0,0,0,1|2,0,0]=4 570 B12R1.19 CC(=O)NC1=CC(F)=C(Br)C=C1 Z0533 [0,1,0,0,0,1|1,0,0]=3 571 B12R1.19 CC(=O)NC1=CC(N)=C(C)C=C1 7210AE [0,1,0,0,0,1|0,0,0]=2 572 B12R1.19 CC(=O)NC1=CC=C(Cl)C(O)=C1 V4906 [0,1,0,0,0,1|1,0,0]=3 573 B12R1.19 CC(=O)NC1=CN=C(Br)C(C)=C1 V9870 [0,1,0,0,0,1|2,0,0]=4 574 B12R1.19 CC(=O)NC1=NC=C(Cl)C(C)=C1 V3405 [0,1,0,0,0,1|2,0,0]=4 575 B12R1.19 CC(=O)NC1=NC=C(N)C(C)=C1 N471 [0,1,0,0,0,1|2,0,0]=4 576 B12R1.19 CC1=C(F)C=C(CC(=O)O)C=C1 2282AB [0,1,0,0,0,1|1,0,0]=3 577 B12R1.19 NC1=CC(CC(=O)O)=CC=C1O 2074AE [0,1,0,0,0,1|2,0,0]=4 578 B12R1.19 NC1=CC=C(CC(=O)O)C=C1F Z4803 [0,1,0,0,0,1|2,0,0]=4 579 B12R1.19 NC1=CC=C(CC(=O)O)C=C1I 3795AD [0,1,0,0,0,1|2,0,0]=4 580 B12R1.20 CC(=O)C(Br)C1=CC=C(O)C=C1 6547AC [0,1,0,0,0,1|1,0,0]=3 581 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 4424AE [0,1,0,0,0,1|1,0,0]=3 582 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 V7421 [0,1,0,0,0,1|2,0,0]=4 583 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 5426AJ [0,1,0,0,0,1|2,0,0]=4 584 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Br)C=C1 3070AC [0,1,0,0,0,1|2,0,0]=4 585 B12R1.20 O=C(O)C(Br)C1=CC=C(Cl)C=C1 Y6551 [0,1,0,0,0,1|2,0,0]=4 586 B12R1.20 O=C(O)C(Br)C1=CC=C(F)C=C1 1179AQ [0,1,0,0,0,1|2,0,0]=4 587 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(Cl)C=C1 Z5112 [0,1,0,0,0,1|2,0,0]=4 588 B12R1.20 O=C([O-])C(O)C1=CC=C(O)C=C1 0691AC [0,1,0,0,0,1|2,0,0]=4 589 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 5933AE [0,1,0,0,0,1|1,0,0]=3 590 B12R1.49 CC1=CC=C(NC(=O)CN)C=C1 5390AE [0,1,0,0,0,1|0,0,0]=2 591 B12R1.49 CC1=CC=C(OC(C)CN)C=C1 7330AE [0,1,0,0,0,1|1,0,1]=4 592 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 0275AE [0,1,0,0,0,1|1,0,0]=3 593 B12R1.49 COC(=O)NC1=NC=C(Br)C=C1 V4263 [0,1,0,0,0,1|2,0,0]=4 594 B12R1.49 NNC(=O)CC1=CC=C(Br)C=C1 5932AE [0,1,0,0,0,1|2,0,0]=4 595 B12R1.49 O=C(CBr)NC1=CC=C(Br)C=C1 5316AE [0,1,0,0,0,1|1,0,0]=3 596 B12R1.49 O=C(CBr)NC1=CC=C(Cl)C=C1 5089AE [0,1,0,0,0,1|1,0,0]=3 597 B12R1.49 O=C(CCl)NC1=NC=C(Cl)C=C1 2853AF [0,1,0,0,0,1|2,0,0]=4 598 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 8448AE [0,1,0,0,0,1|1,0,0]=3 599 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 7376AE [0,1,0,0,0,1|2,0,0]=4 600 B12R1.106 CC1=CC=C(OC(C)(C)C)C=C1 1467AL [0,1,0,0,0,1|1,0,1]=4 601 B12R1.106 CS(=O)(=O)CC1=CC=C(N)C=C1 8158AD [0,1,0,0,0,1|2,0,0]=4 602 B12R1.106 CS(=O)(=O)NC1=CC=C(Br)C=C1 X5288 [0,1,0,0,0,1|2,0,0]=4 603 B12R1.233 CC(=O)CC1=CC=C(Cl)C=C1Br 5576AA [0,1,0,0,0,1|1,0,0]=3 604 B12R1.233 CC(=O)NC1=C(Br)C=C(Br)C=N1 9736AL [0,1,0,0,0,1|2,0,0]=4 605 B12R1.233 CC(=O)NC1=C(C)C=C(N)N=C1 9416AA [0,1,0,0,0,1|2,0,0]=4 606 B12R1.233 CC(=O)NC1=C(Cl)C=C(N)C=C1 8491AB [0,1,0,0,0,1|1,0,0]=3 607 B12R1.233 CC(=O)NC1=CC=C(C)C=C1N Y9371 [0,1,0,0,0,1|0,0,0]=2 608 B12R1.233 CC(=O)NC1=CC=C(I)C=C1F V9891 [0,1,0,0,0,1|1,0,0]=3 609 B12R1.233 CC(=O)NC1=CN=C(Cl)C=C1C Z2936 [0,1,0,0,0,1|2,0,0]=4 610 B12R1.233 CC(=O)NC1=NC=C(N)C=C1Br V8830 [0,1,0,0,0,1|2,0,0]=4 611 B12R1.233 O=C(O)CC1=C(Br)C=C(O)C=C1 5009AH [0,1,0,0,0,1|2,0,0]=4 612 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 X9190 [0,2,0,0,0,0|0,0,1]=3 613 B12R1.5 CCC1=CC=C(C(=O)NN)C=C1 Y9705 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 V3654 [0,2,0,0,0,0|0,0,0]=2 615 B12R1.5 CNC(=O)C1=CC=C(SC)C=C1 7628AB [0,2,0,0,0,0|0,0,0]=2 616 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 1521AA [0,2,0,0,0,0|1,0,0]=3 617 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 Y7491 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 X3533 [0,2,0,0,0,0|1,0,0]=3 619 B12R1.5 COC(=O)C1=CC=C(SC)C=C1 4870AB [0,2,0,0,0,0|0,0,0]=2 620 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 5893AA [0,2,0,0,0,0|1,0,0]=3 621 B12R1.5 COC1=CC=C(C(=O)C#N)C=C1 8793AH [0,2,0,0,0,0|0,0,1]=3 622 B12R1.5 COC1=CC=C(C(=O)CO)C=C1 2924AE [0,2,0,0,0,0|0,0,0]=2 623 B12R1.5 COC1=CC=C(C(=O)ON)C=C1 1197AF [0,2,0,0,0,0|1,0,0]=3 624 B12R1.5 COC1=CC=C(C(O)CN)C=C1 5057AH [0,2,0,0,0,0|0,0,2]=4 625 B12R1.5 COC1=CC=C(N(C)C=O)C=C1 6568AL [0,2,0,0,0,0|1,0,0]=3 626 B12R1.5 COC1=CN=C(C(=O)NN)C=C1 5008AA [0,2,0,0,0,0|2,0,0]=4 627 B12R1.5 CSC1=CC=C(C(=O)C=O)C=C1 7517AB [0,2,0,0,0,0|0,0,1]=3 628 B12R1.5 N#CC1=CC=C(C(=O)C=O)C=C1 W4089 [0,2,0,0,0,0|0,0,2]=4 629 B12R1.5 NCC1=CC=C(C(=O)NN)C=C1 4284AB [0,2,0,0,0,0|1,0,0]=3 630 B12R1.6 CNC1=CC=C(S(C)(=O)=O)C=C1 3443AA [0,2,0,0,0,0|1,0,0]=3 631 B12R1.6 CNC1=CC=C(S(C)(=O)=O)C=C1 X9671 [0,2,0,0,0,0|1,0,0]=3 632 B12R1.6 CSC1=CC=C(S(=O)(=O)Cl)C=C1 Z2772 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 W3020 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.48 CC(=O)C1=CC=C(C#N)C(S)=N1 5823AD [0,2,0,0,0,0|1,0,1]=4 635 B12R1.48 CC1=CC(C(=O)O)=CC=C1C=O V4609 [0,2,0,0,0,0|1,0,1]=4 636 B12R1.48 CCC1=C(Br)C=C(C(=O)O)C=C1 6984AC [0,2,0,0,0,0|1,0,0]=3 637 B12R1.48 CCC1=CC=C(C(=O)O)C=C1I 6156AJ [0,2,0,0,0,0|1,0,0]=3 638 B12R1.48 CCC1=CC=C(C(=O)O)C=C1O Q690 [0,2,0,0,0,0|1,0,0]=3 639 B12R1.48 CNC1=CC=C([N+](=O)[O-])C=C1Br V7313 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.48 COC1=C(Br)C=C(C(=N)N)C=C1 2191AJ [0,2,0,0,0,0|2,0,0]=4 641 B12R1.48 COC1=C(Br)C=C(C(=N)N)C=C1 2192AJ [0,2,0,0,0,0|2,0,0]=4 642 B12R1.48 COC1=C(Br)C=C(C(N)=O)C=C1 6775AD [0,2,0,0,0,0|1,0,0]=3 643 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 5479AC [0,2,0,0,0,0|1,0,1]=4 644 B12R1.48 O=[N+]([O-])C1=CC=C(CBr)C(Br)=C1 W9650 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.113 CC(=O)C1=CC=C(CCBr)C=C1 5439AB [0,2,0,0,0,0|0,0,0]=2 646 B12R1.113 CC(=O)C1=CC=C(CCCl)C=C1 8308AE [0,2,0,0,0,0|0,0,0]=2 647 B12R1.113 CC(C)C1=CC=C(CNN)C=C1 0542AD [0,2,0,0,0,0|1,0,1]=4 648 B12R1.113 CCCC1=CC=C(C(C)N)C=C1 2970AF [0,2,0,0,0,0|1,0,1]=4 649 B12R1.113 CCNC1=CC=C([N+](=O)[O-])C=C1 1722AE [0,2,0,0,0,0|2,0,0]=4 650 B12R1.113 CCOC1=CC=C(C(N)=S)C=C1 V1636 [0,2,0,0,0,0|1,1,0]=4 651 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 6886AC [0,2,0,0,0,0|2,0,0]=4 652 B12R1.113 CCOC1=NC=C(C(=O)O)C=C1 W9824 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 7699AC [0,2,0,0,0,0|2,0,0]=4 654 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 W6734 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 4511AF [0,2,0,0,0,0|1,0,0]=3 656 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 Z6667 [0,2,0,0,0,0|1,0,0]=3 657 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 2886AC [0,2,0,0,0,0|2,0,0]=4 658 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 7853AE [0,2,0,0,0,0|1,0,0]=3 659 B12R1.113 CSCC1=CC=C(C(=O)O)C=C1 0287AC [0,2,0,0,0,0|1,0,0]=3 660 B12R1.113 NC(=O)C1=CC=C(N=C=S)C=C1 Z2884 [0,2,0,0,0,0|1,0,1]=4 661 B12R1.113 O=CCC1=CC=C([N+](=O)[O-])C=C1 7227AA [0,2,0,0,0,0|2,0,0]=4 662 B12R1.256 C=C(C)C1=CC=C(C(=C)C)C=C1 8094AA [0,2,0,0,0,0|1,0,0]=3 663 B12R1.256 CC(=O)C1=CN=C(C(=O)O)C=C1 Y9735 [0,2,0,0,0,0|1,0,1]=4 664 B12R1.256 CC(C)C1=CC=C(C(C)N)C=C1 8973AE [0,2,0,0,0,0|1,0,1]=4 665 B12R1.256 CC(C)C1=CC=C(C(N)=S)C=C1 5121AE [0,2,0,0,0,0|1,1,0]=4 666 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 2416AJ [0,2,0,0,0,0|1,0,0]=3 667 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 2771AB [0,2,0,0,0,0|1,0,0]=3 668 B12R1.256 CN(C)C1=CC=C([N+](=O)[O-])C=C1 Z3701 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.256 CS(=O)C1=CC=C(C(=O)O)C=C1 4031AB [0,2,0,0,0,0|1,0,0]=3 670 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2000AA [0,2,0,0,0,0|1,0,0]=3 671 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2927AH [0,2,0,0,0,0|1,0,0]=3 672 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 1165AB [0,2,0,0,0,0|2,0,0]=4 673 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 9180AH [0,2,0,0,0,0|1,0,0]=3 674 B12R1.256 C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1 5765AB [0,2,0,0,0,0|2,0,0]=4 675 B12R1.256 NC(=O)C1=CC=C(C(N)=O)C=C1 9023AL [0,2,0,0,0,0|1,0,1]=4 676 B12R1.452 CC(=O)C1=CC=C(C#N)C=C1C 5552AH [0,2,0,0,0,0|0,0,1]=3 677 B12R1.452 CNC1=CC=C(C(=O)O)C(O)=C1 0735AC [0,2,0,0,0,0|1,0,0]=3 678 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 R458 [0,2,0,0,0,0|1,0,0]=3 679 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 5625AB [0,2,0,0,0,0|0,0,0]=2 680 B12R1.452 COC1=CC=C(C(=O)O)C(C)=N1 Y7274 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.452 COC1=CC=C(C(=O)O)C(I)=C1 Z4862 [0,2,0,0,0,0|1,0,0]=3 682 B12R1.452 COC1=CN=C(C(=O)O)C(Cl)=C1 5399AA [0,2,0,0,0,0|2,0,0]=4 683 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 1537AJ [0,2,0,0,0,0|2,0,0]=4 684 B12R1.452 CSC1=NC(C)=C(C(C)=O)C=N1 4573AH [0,2,0,0,0,0|2,0,0]=4 685 B12R1.452 N#CC1=CC=C(C(=O)O)C(I)=C1 4996AA [0,2,0,0,0,0|1,0,1]=4 686 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 1182AC [0,2,0,0,0,0|2,0,0]=4 687 B12R1.9 CCS(=O)(=O)C1=CC=C(N)C=C1 V7024 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.9 COS(=O)(=O)C1=CC=C(Cl)C=C1 Z3759 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.9 O=S(=O)(CCl)C1=CC=C(Cl)C=C1 6368AE [0,2,0,0,0,0|2,0,0]=4 690 B12R1.23 CC1=C(Cl)C=C(S(=O)(=O)F)C=C1 0561AQ [0,2,0,0,0,0|2,0,0]=4 691 B12R1.23 CC1=C(N)C=CC(S(C)(=O)=O)=C1 6193AJ [0,2,0,0,0,0|2,0,0]=4 692 B12R1.23 CC1=CC(S(C)(=O)=O)=CC=C1Br V9939 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.23 CC1=CC=C(S(=O)(=O)O)C=C1N I641 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1F 5551AJ [0,2,0,0,0,0|1,0,0]=3 695 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1N 5586AJ [0,2,0,0,0,0|1,0,0]=3 696 B12R1.23 CC1=CC=C(S(N)(=O)=O)C=C1Br V4310 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.23 CC1=CC=C(S(N)(=O)=O)C=C1N V6971 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.23 CS(=O)(=O)C1=CC=C(Br)C(Br)=C1 V7976 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.23 CS(=O)(=O)C1=CC=C(Cl)C(N)=C1 Z7805 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.23 CS(=O)(=O)C1=CC=C(F)C(Br)=C1 V9859 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.23 CS(=O)(=O)C1=CC=C(N)C(N)=C1 V4386 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.126 CC1=C(S(C)(=O)=O)C=CC(F)=C1 0235AF [0,2,0,0,0,0|2,0,0]=4 703 B12R1.126 CC1=CC(C)=C(S(=O)(=O)O)C=C1 E559 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.126 CS(=O)(=O)C1=C(F)C=C(Cl)C=C1 Y1840 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.126 CS(=O)(=O)C1=CC=C(Br)C=C1Cl V7114 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.126 CS(=O)(=O)C1=CC=C(Br)C=C1O V3220 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.126 CS(=O)(=O)C1=CC=C(F)C=C1Br Z6706 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 2271AJ [0,2,0,0,0,0|1,0,0]=3 709 B12R1.56 CC(=O)C1=CC(C#N)=C(N)C=C1 3962AB [0,2,0,0,0,0|1,0,0]=3 710 B12R1.56 CC1=C(C=O)C=C(C(=O)O)C=C1 5888AJ [0,2,0,0,0,0|1,0,0]=3 711 B12R1.56 CC1=CC=C(C(=O)O)C=C1NN V6890 [0,2,0,0,0,0|1,0,0]=3 712 B12R1.56 COC1=CC(C(N)=O)=CC=C1Br V3839 [0,2,0,0,0,0|2,0,0]=4 713 B12R1.56 O=CC1=C(O)C=CC(C(=O)O)=C1 1099AQ [0,2,0,0,0,0|2,0,0]=4 714 B12R1.232 CC(=O)C1=C(C)C=C(C)C(C)=C1 6898AD [0,2,0,0,0,0|0,0,0]=2 715 B12R1.232 CC(=O)C1=C(C)NC(=O)C(Br)=C1 6439AA [0,2,0,0,0,0|2,0,0]=4 716 B12R1.232 CC(=O)C1=CC(F)=C(Cl)C=C1F 7503AE [0,2,0,0,0,0|1,0,0]=3 717 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1Br 5338AA [0,2,0,0,0,0|1,0,0]=3 718 B12R1.232 CC1=C(C)C=C([N+](=O)[O-])C(O)=C1 6067AD [0,2,0,0,0,0|2,0,0]=4 719 B12R1.232 CC1=C(C)NC(=O)C(C(=O)O)=C1 7229AB [0,2,0,0,0,0|2,0,0]=4 720 B12R1.232 CC1=C(Cl)C=C(N)C(C(=O)O)=C1 V3515 [0,2,0,0,0,0|2,0,0]=4 721 B12R1.232 CC1=C(F)C=C([N+](=O)[O-])C(Br)=C1 V4267 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.232 CC1=C(F)C=C([N+](=O)[O-])C(N)=C1 6817AC [0,2,0,0,0,0|2,0,0]=4 723 B12R1.232 CC1=C(I)C=C(C(=O)O)C(O)=C1 Z1826 [0,2,0,0,0,0|1,0,0]=3 724 B12R1.232 CC1=C(N)C=C(C(=O)O)C(Br)=C1 1570AC [0,2,0,0,0,0|1,0,0]=3 725 B12R1.232 CC1=C(O)C=C(C(C)C)C(Br)=C1 1230AD [0,2,0,0,0,0|1,0,1]=4 726 B12R1.232 CC1=CC(C)=C(Cl)C=C1[N+](=O)[O-] 0712AC [0,2,0,0,0,0|2,0,0]=4 727 B12R1.232 CC1=CC(C)=C(F)C=C1[N+](=O)[O-] 4163AB [0,2,0,0,0,0|2,0,0]=4 728 B12R1.232 CC1=CC(C)=C(I)C=C1C(=O)O 1531AC [0,2,0,0,0,0|1,0,0]=3 729 B12R1.232 CC1=CC(Cl)=C([N+](=O)[O-])C=C1C 4975AE [0,2,0,0,0,0|2,0,0]=4 730 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N 7086AE [0,2,0,0,0,0|1,0,1]=4 731 B12R1.232 CC1=CC(O)=C(C)C=C1C(=O)O 6178AJ [0,2,0,0,0,0|2,0,0]=4 732 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 2878AL [0,2,0,0,0,0|2,0,0]=4 733 B12R1.232 NC1=C(Cl)C=C(O)C(C(=O)O)=C1 V1240 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.232 NC1=C(F)C=C(Cl)C(C(=O)O)=C1 V3771 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.232 NC1=C(F)C=C(F)C(C(=O)O)=C1 V7064 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.232 NC1=CC(Cl)=C(Cl)C=C1C(=O)O W4361 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1Cl 2380AC [0,2,0,0,0,0|2,0,0]=4 738 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1O 8358AA [0,2,0,0,0,0|2,0,0]=4 739 B12R1.232 O=C(O)C1=CC(O)=C(Br)C=C1Br W3127 [0,2,0,0,0,0|2,0,0]=4 740 B12R1.232 O=C([O-])C1=CC(F)=C(F)C=C1F Z1833 [0,2,0,0,0,0|2,0,0]=4 741 B12R1.367 CC1=C(Br)C=CC(C(=O)CBr)=C1 3315AB [0,2,0,0,0,0|1,0,0]=3 742 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 4488AE [0,2,0,0,0,0|0,0,0]=2 743 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1C 2008AL [0,2,0,0,0,0|0,0,0]=2 744 B12R1.367 CC1=CC=C(C(=O)NN)C=C1Br 4702AE [0,2,0,0,0,0|1,0,0]=3 745 B12R1.367 CC1=CC=C(C(=O)NN)C=C1N 0486AF [0,2,0,0,0,0|1,0,0]=3 746 B12R1.367 CC1=CC=C(C(N)CO)C=C1C 4968AH [0,2,0,0,0,0|1,0,1]=4 747 B12R1.367 CCC(=O)C1=CC(Cl)=C(F)C=C1 0087AB [0,2,0,0,0,0|1,0,0]=3 748 B12R1.367 CCC(=O)C1=CC=C(Br)C(C)=C1 V4296 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=N1 4840AA [0,2,0,0,0,0|1,0,0]=3 750 B12R1.367 COC(=O)C1=CC(Cl)=C(N)N=C1 0808AF [0,2,0,0,0,0|2,0,0]=4 751 B12R1.367 COC(=O)C1=CC(N)=C(Cl)N=C1 V4323 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.367 COC(=O)C1=CC(N)=C(O)N=C1 V4477 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.367 COC(=O)C1=CC=C(Cl)C(=O)N1 3888AA [0,2,0,0,0,0|2,0,0]=4 754 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 Z4261 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.367 COC(=O)C1=CN=C(C)C(C)=N1 4479AA [0,2,0,0,0,0|2,0,0]=4 756 B12R1.367 COC(=O)C1=CN=C(O)C(Cl)=C1 1162AD [0,2,0,0,0,0|2,0,0]=4 757 B12R1.367 COC(=O)C1=CNC(=O)C(Cl)=C1 0022AE [0,2,0,0,0,0|2,0,0]=4 758 B12R1.367 COC(=O)C1=NC(Br)=C(C)C=C1 Z3978 [0,2,0,0,0,0|1,0,0]=3 759 B12R1.367 COC(=O)C1=NC(C)=C(Br)C=C1 Y3851 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.367 COC(=O)C1=NC=C(C)C(Cl)=C1 X8939 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.367 COC(=O)C1=NC=C(N)C(N)=C1 Z5185 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.367 N#CC(=O)C1=CC=C(F)C(Cl)=C1 Y1449 [0,2,0,0,0,0|1,0,1]=4 763 B12R1.367 NCC(=O)C1=CC=C(Br)C(F)=C1 4964AA [0,2,0,0,0,0|1,0,0]=3 764 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 5784AB [0,2,0,0,0,0|1,0,0]=3 765 B12R1.367 NNC(=O)C1=CC(Br)=C(Cl)C=C1 4586AD [0,2,0,0,0,0|2,0,0]=4 766 B12R1.367 NNC(=O)C1=CC=C(F)C(Br)=C1 V9245 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.367 O=C(CBr)C1=CC(Br)=C(F)C=C1 1021AQ [0,2,0,0,0,0|1,0,0]=3 768 B12R1.367 O=C(CBr)C1=CC=C(Br)C(F)=C1 0190AA [0,2,0,0,0,0|1,0,0]=3 769 B12R1.367 O=C(CCl)C1=CC=C(O)C(Cl)=C1 2324AE [0,2,0,0,0,0|1,0,0]=3 770 B12R1.367 O=C(CO)C1=CC(Cl)=C(Cl)C=C1 9016AC [0,2,0,0,0,0|1,0,0]=3 771 B12R1.893 CC(=O)C1=C(F)C(F)=C(C)C=C1 8665AD [0,2,0,0,0,0|0,0,0]=2 772 B12R1.893 CC(=O)C1=CC=C(O)C(C)=C1C 7691AB [0,2,0,0,0,0|1,0,0]=3 773 B12R1.893 CC1=C(O)C(C)=C([N+](=O)[O-])C=C1 8372AE [0,2,0,0,0,0|2,0,0]=4 774 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C 2119AF [0,2,0,0,0,0|2,0,0]=4 775 B12R1.893 CC1=CC=C(C(=O)O)C(I)=C1C 5511AA [0,2,0,0,0,0|1,0,0]=3 776 B12R1.893 CC1=CC=C([N+](=O)[O-])C(C)=C1I 2863AE [0,2,0,0,0,0|2,0,0]=4 777 B12R1.893 CC1=CC=C([N+](=O)[O-])C(C)=C1N 0309AC [0,2,0,0,0,0|2,0,0]=4 778 B12R1.1005 CC(=O)C1=CC(Br)=C(N)C(Br)=C1 9447AH [0,2,0,0,0,0|1,0,0]=3 779 B12R1.1005 CC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 8744AA [0,2,0,0,0,0|1,0,0]=3 780 B12R1.1005 CC(=O)C1=CC(F)=C(O)C(F)=C1 3797AD [0,2,0,0,0,0|1,0,0]=3 781 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1N Z1761 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.1005 CC1=C(N)C=C([N+](=O)[O-])C=C1N 8809AB [0,2,0,0,0,0|2,0,0]=4 783 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Cl Z1063 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1O 6672AB [0,2,0,0,0,0|2,0,0]=4 785 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1N 0906AA [0,2,0,0,0,0|2,0,0]=4 786 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(C)=C1C 7395AB [0,2,0,0,0,0|2,0,0]=4 787 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(N)=C1C 1866AA [0,2,0,0,0,0|2,0,0]=4 788 B12R1.1005 NC1=C(I)C=C(C(=O)O)C=C1I 0823AB [0,2,0,0,0,0|2,0,0]=4 789 B12R1.1005 NC1=CC(C(=O)O)=CC(Br)=C1F Z9454 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.1005 NC1=CC(C(=O)O)=CC(Cl)=C1Cl 7049AB [0,2,0,0,0,0|2,0,0]=4 791 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 Y3753 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.1005 O=C(O)C1=CC(F)=C(F)C(Cl)=C1 Z1789 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.1005 O=C(O)C1=CC(I)=C(Br)C(I)=C1 3451AC [0,2,0,0,0,0|2,0,0]=4 794 B12R1.1005 O=C(O)C1=CC(I)=C(I)C(I)=C1 1545AB [0,2,0,0,0,0|2,0,0]=4 795 B12R1.12 CCC(NO)=C1C=CC(=O)C=C1 3821AD [0,2,0,0,0,0|1,0,1]=4 796 B12R1.16 CC1=CC=C([C@H](N)CCO)C=C1 1218AL [0,2,0,0,0,0|1,0,1]=4 797 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 2319AF [0,2,0,0,0,0|1,0,0]=3 798 B12R1.16 CCNC(=O)C1=NC=C(Br)C=C1 V7933 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 4591AD [0,2,0,0,0,0|2,0,0]=4 800 B12R1.16 CCOC(=O)C1=CN=C(C)N=C1 Z4406 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 3468AD [0,2,0,0,0,0|2,0,0]=4 802 B12R1.16 CCOC(=O)C1=NC=C(F)C=C1 4575AD [0,2,0,0,0,0|2,0,0]=4 803 B12R1.16 N#CCC(=O)C1=CC=C(I)C=C1 0579AB [0,2,0,0,0,0|1,0,0]=3 804 B12R1.16 O=C(CCO)C1=CC=C(O)C=C1 5738AJ [0,2,0,0,0,0|1,0,0]=3 805 B12R1.16 O=C(\C=N\O)C1=CC=C(Br)C=C1 9214AJ [0,2,0,0,0,0|1,0,1]=4 806 B12R1.16 O=C\C=C(/Cl)C1=CC=C(Cl)C=C1 V8620 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.1703 C=C(CO)C1=CC=C(F)C=C1F 1023AJ [0,2,0,0,0,0|2,0,0]=4 808 B12R1.1703 CC1=C(C(=O)NN)C=CC(Cl)=C1 9223AE [0,2,0,0,0,0|2,0,0]=4 809 B12R1.1703 CC1=CC=C(C(N)CO)C(C)=C1 4966AH [0,2,0,0,0,0|1,0,1]=4 810 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 L067 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1O 8970AC [0,2,0,0,0,0|1,0,0]=3 812 B12R1.1703 CCC(N)C1=C(C)C=C(C)C=C1 1957AF [0,2,0,0,0,0|1,0,1]=4 813 B12R1.1703 CNC(=O)C1=CC=C(Br)C=C1Cl V8785 [0,2,0,0,0,0|1,0,0]=3 814 B12R1.1703 CNC(=O)C1=NC=C(Br)C=C1C Y3870 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 1844AA [0,2,0,0,0,0|2,0,0]=4 816 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 6069AB [0,2,0,0,0,0|1,0,0]=3 817 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1Cl 2363AA [0,2,0,0,0,0|2,0,0]=4 818 B12R1.1703 COC(=O)C1=CC=C(C)N=C1C 1416AJ [0,2,0,0,0,0|1,0,0]=3 819 B12R1.1703 COC(=O)C1=CC=C(I)C=C1N 7124AA [0,2,0,0,0,0|1,0,0]=3 820 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl 0202AA [0,2,0,0,0,0|2,0,0]=4 821 B12R1.1703 COC(=O)C1=CN=C(C)C=C1Cl 4512AC [0,2,0,0,0,0|1,0,0]=3 822 B12R1.1703 COC(=O)C1=CN=C(O)C=C1O W8494 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.1703 COC(=O)C1=NC=C(C)N=C1Cl 3388AC [0,2,0,0,0,0|2,0,0]=4 824 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br 3863AA [0,2,0,0,0,0|2,0,0]=4 825 B12R1.1703 C\C(=N/O)C1=C(O)C=C(O)C=C1 9189AB [0,2,0,0,0,0|1,0,1]=4 826 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 X4745 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.1703 NCC(=O)C1=CC=C(Cl)C=C1Cl L157 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.1703 NNC(=O)C1=C(Cl)C=C(Br)C=C1 7001AD [0,2,0,0,0,0|2,0,0]=4 829 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1O 7557AE [0,2,0,0,0,0|2,0,0]=4 830 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 5007AH [0,2,0,0,0,0|1,0,0]=3 831 B12R1.1703 O=C(CBr)C1=CC=C(Br)C=C1F V8244 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1Cl V6902 [0,2,0,0,0,0|1,0,0]=3 833 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F Z6528 [0,2,0,0,0,0|1,0,0]=3 834 B12R1.1703 O=C(CCl)C1=CC=C(F)C=C1O 5512AJ [0,2,0,0,0,0|1,0,0]=3 835 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O 8362AD [0,2,0,0,0,0|1,0,0]=3 836 B12R1.1703 O=C(NO)C1=C(O)C=C(Br)C=C1 6761AE [0,2,0,0,0,0|2,0,0]=4 837 B12R1.57 COC1=C(C(=O)O)C=CC(I)=C1 1142AQ [0,2,0,0,0,0|2,0,0]=4 838 B12R1.57 COC1=CC(Br)=CC=C1C(N)=O V7847 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.57 COC1=CC(N)=CC=C1C(C)=O 8976AB [0,2,0,0,0,0|1,0,0]=3 840 B12R1.57 COC1=CC(O)=CC=C1C(=O)O X8080 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.1000 CC(=O)C1=C(C)C=C(C)C=C1O 8146AA [0,2,0,0,0,0|0,0,0]=2 842 B12R1.1000 CC(=O)C1=C(F)C=C(Cl)C=C1F X8576 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.1000 CC(=O)C1=C(O)C=C(Cl)C=C1F 2027AA [0,2,0,0,0,0|1,0,0]=3 844 B12R1.1000 CC1=C(C(=O)O)C(Cl)=CC(Cl)=C1 7482AE [0,2,0,0,0,0|2,0,0]=4 845 B12R1.1000 CC1=C(C(N)=O)C(Cl)=CC(Cl)=C1 9176AA [0,2,0,0,0,0|2,0,0]=4 846 B12R1.1000 CC1=CC(=O)C(C(=O)O)=C(C)N1 3858AB [0,2,0,0,0,0|2,0,0]=4 847 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(=O)N1 1888AB [0,2,0,0,0,0|2,0,0]=4 848 B12R1.1000 CC1=CC(C)=C(S(=O)[O-])C(C)=C1 V6289 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.1000 CC1=CC(C)=NC(N)=C1C(N)=O 8598AE [0,2,0,0,0,0|2,0,0]=4 850 B12R1.1000 CC1=CC(Cl)=C(C(=O)O)C(Cl)=C1 Z1217 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.1000 CC1=CC(F)=CC(C)=C1C(=O)O W3618 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.1000 CC1=CC(O)=CC(O)=C1C(=O)O 6587AB [0,2,0,0,0,0|2,0,0]=4 853 B12R1.1000 O=C(O)C1=C(Br)C=C(F)C=C1Br 9899AL [0,2,0,0,0,0|2,0,0]=4 854 B12R1.1000 O=C(O)C1=C(Cl)C=C(I)C=C1Cl 3258AD [0,2,0,0,0,0|2,0,0]=4 855 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1Br Z0295 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1O 9859AA [0,2,0,0,0,0|2,0,0]=4 857 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 Z4891 [0,0,0,1,0,1|1,0,0]=3 858 B12R2.606 CC1=CC2=C(C=C1)N=C(C)S2 2982AB [0,0,0,1,0,1|0,1,0]=3 859 B12R2.606 CC1=CC2=C(C=C1)NC(C)C2 1404AJ [0,0,0,1,0,1|1,0,1]=4 860 B12R2.606 CC1=CC2=C(C=C1)SC(C)=N2 5377AL [0,0,0,1,0,1|1,0,0]=3 861 B12R2.606 CC1=CC2=C(C=C1)SC(Cl)=N2 4578AB [0,0,0,1,0,1|2,0,0]=4 862 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 8094AD [0,0,0,1,0,1|2,0,0]=4 863 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 5410AB [0,0,0,1,0,1|2,0,0]=4 864 B12R2.606 CC1=CC=C2OC(Cl)=NC2=C1 Y8920 [0,0,0,1,0,1|2,0,0]=4 865 B12R2.606 CC1=CC=C2SC(N)=NC2=C1 U498 [0,0,0,1,0,1|2,0,0]=4 866 B12R2.606 CC1=CN=C2CC(=O)NC2=C1 X9359 [0,0,0,1,0,1|2,0,0]=4 867 B12R2.606 CC1=NC2=C(C=C(F)C=C2)O1 0924AQ [0,0,0,1,0,1|1,0,1]=4 868 B12R2.606 CC1=NC2=C(C=CC(F)=C2)S1 5280AB [0,0,0,1,0,1|2,0,0]=4 869 B12R2.606 CC1=NC2=C(C=CC(N)=C2)S1 0888AQ [0,0,0,1,0,1|2,0,0]=4 870 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 V4553 [0,0,0,1,0,1|2,0,0]=4 871 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 Y9927 [0,0,0,1,0,1|2,0,0]=4 872 B12R2.606 NC1=CC=C2NC(=O)SC2=C1 8244AB [0,0,0,1,0,1|2,0,0]=4 873 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 V2187 [0,0,0,1,0,1|1,0,0]=3 874 B12R2.606 O=C1CC2=C(C=NC(Br)=C2)N1 3955AA [0,0,0,1,0,1|2,0,0]=4 875 B12R2.606 O=C1CC2=C(C=NC(Cl)=C2)N1 X9964 [0,0,0,1,0,1|2,0,0]=4 876 B12R2.606 O=C1CC2=CC(Cl)=CN=C2N1 X9350 [0,0,0,1,0,1|2,0,0]=4 877 B12R2.606 O=C1CC2=CC=C(O)C=C2O1 W1997 [0,0,0,1,0,1|2,0,0]=4 878 B12R2.606 O=C1CC2=NC(Cl)=CC=C2N1 X9963 [0,0,0,1,0,1|2,0,0]=4 879 B12R2.606 O=C1NC2=C(C=C(I)C=C2)O1 6712AD [0,0,0,1,0,1|2,0,0]=4 880 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 2094AC [0,0,0,1,0,1|2,0,0]=4 881 B12R2.1384 O=C(O)C1=CC=C2C=CC2=C1 L676 [0,1,0,1,0,0|1,0,1]=4 882 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 6903AB [0,1,0,1,0,0|1,0,1]=4 883 B12R2.612 CC1=CC2=C(C=C1)C(N)CC2 8637AA [0,1,0,1,0,0|1,0,1]=4 884 B12R2.612 CC1=CC2=C(C=C1)C(O)CC2 3976AB [0,1,0,1,0,0|0,0,2]=4 885 B12R2.612 CC1=CC=C2C(=C1)NN=C2Cl 5317AH [0,1,0,1,0,0|2,0,0]=4 886 B12R2.612 CC1=CC=C2C(=O)OCC2=C1 3272AJ [0,1,0,1,0,0|0,0,0]=2 887 B12R2.612 CC1=NNC2=C1C=CC(O)=C2 W4256 [0,1,0,1,0,0|2,0,0]=4 888 B12R2.612 CC1=NOC2=CC(Cl)=CC=C21 V7165 [0,1,0,1,0,0|1,0,1]=4 889 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 1199AB [0,1,0,1,0,0|2,0,0]=4 890 B12R2.612 O=C1NCC2=C1C=CC(O)=C2 Z4499 [0,1,0,1,0,0|1,0,0]=3 891 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 Z5210 [0,1,0,1,0,0|2,0,0]=4 892 B8R1.1 CC1=CC=C(C=O)N1 3298AA [1,0,0,0,1,0|1,0,0]=3 893 B8R1.1 CC1=NOC(C=O)=C1 Y9882 [1,0,0,0,1,0|2,0,0]=4 894 B8R1.1 CSC1=CC(C)=CS1 Z0195 [1,0,0,0,1,0|2,0,0]=4 895 B8R1.1 O=CC1=CC(Cl)=CS1 8472AB [1,0,0,0,1,0|2,0,0]=4 896 B8R1.7 CC(=O)C1=CC=NO1 4156AC [1,0,0,0,1,0|2,0,0]=4 897 B8R1.7 CC(=O)C1=CN=CS1 5381AC [1,0,0,0,1,0|2,0,0]=4 898 B8R1.7 CC(=O)C1=NC=CO1 W8389 [1,0,0,0,1,0|2,0,0]=4 899 B8R1.7 CC(=O)C1=NOC=C1 4155AC [1,0,0,0,1,0|2,0,0]=4 900 B8R1.7 NC(=O)C1=CC=CN1 V6031 [1,0,0,0,1,0|2,0,0]=4 901 B8R1.7 NC(=O)C1=CNC=C1 1113AC [1,0,0,0,1,0|2,0,0]=4 902 B8R1.7 O=C(O)N1C=CC=C1 Z3516 [1,0,0,0,1,0|2,0,0]=4 903 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [1,0,0,0,0,1|1,0,0]=3 904 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [1,0,0,0,0,1|2,0,0]=4 905 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [1,0,0,0,0,1|0,1,0]=3 906 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [1,0,0,0,0,1|1,0,0]=3 907 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [1,0,0,0,0,1|0,0,2]=4 908 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [1,0,0,0,0,1|0,0,2]=4 909 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [1,0,0,0,0,1|2,0,0]=4 910 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [1,0,0,0,0,1|1,1,0]=4 911 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [1,0,0,0,0,1|2,0,0]=4 912 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [1,0,0,0,0,1|1,1,0]=4 913 B12R1.21 CC(=O)CCC1=CC=C(Cl)C=C1 1146AE [0,0,0,0,0,2|1,0,0]=3 914 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 0960AQ [0,0,0,0,0,2|1,0,0]=3 915 B12R1.21 CC(=O)NNC1=NC=C(Br)C=C1 Z8166 [0,0,0,0,0,2|2,0,0]=4 916 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 8152AA [0,0,0,0,0,2|1,0,0]=3 917 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7457AD [0,0,0,0,0,2|1,0,0]=3 918 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7458AD [0,0,0,0,0,2|1,0,0]=3 919 B12R1.21 CC1=CC=C(NNC(N)=S)C=C1 9022AE [0,0,0,0,0,2|1,1,0]=4 920 B12R1.21 CC1=CC=C(NNC(N)=S)C=C1 9023AE [0,0,0,0,0,2|1,1,0]=4 921 B12R1.21 CC1=CC=C(OCC(C)O)C=C1 4293AL [0,0,0,0,0,2|0,0,2]=4 922 B12R1.21 CC1=CC=C(\C=C\C(=O)Cl)C=C1 3924AD [0,0,0,0,0,2|1,0,0]=3 923 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 6031AE [0,0,0,0,0,2|2,0,0]=4 924 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 9422AE [0,0,0,0,0,2|2,0,0]=4 925 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 7761AB [0,0,0,0,0,2|2,0,0]=4 926 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Br)C=C1 3925AD [0,0,0,0,0,2|2,0,0]=4 927 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 Z4594 [0,0,0,0,0,2|2,0,0]=4 928 B12R1.21 O=C(O)C=CC1=CC=C(S)C=C1 2914AB [0,0,0,0,0,2|2,0,0]=4 929 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 6555AL [0,0,0,0,0,2|2,0,0]=4