0 B11R1.16 CCCC(=O)C1=CC=NC=C1 8728AA [0,0,0,0,0,0|2,0,0]=2 1 B11R1.16 CCCC(=O)C1=CN=CC=C1 8727AA [0,0,0,0,0,0|2,0,0]=2 2 B11R1.16 CCCC(=O)C1=NC=CC=C1 V4534 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.16 CCCC(=O)C1=NC=CN=C1 9293AB [0,0,0,0,0,0|3,0,0]=3 4 B11R1.16 CCCC(O)C1=CC=CC=C1 4946AL [0,0,0,0,0,0|1,0,2]=3 5 B11R1.16 CCNC(=O)C1=CC=CN=C1 8551AL [0,0,0,0,0,0|2,0,0]=2 6 B11R1.16 CCOC(=O)C1=CC=NC=N1 X0336 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.16 CCOC(=O)C1=NC=CN=C1 X5895 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.16 CCOC(=O)C1CC=CCC1 4681AD [0,0,0,0,0,0|0,0,4]=4 9 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 1965AB [0,0,0,0,0,0|1,0,0]=1 10 B11R1.16 CN(CCN)C1=CC=CC=C1 3619AL [0,0,0,0,0,0|4,0,0]=4 11 B11R1.16 CNCC(O)C1=CC=CC=C1 7554AE [0,0,0,0,0,0|2,0,2]=4 12 B11R1.16 CNOC(=O)C1=CC=CC=C1 8702AL [0,0,0,0,0,0|1,0,0]=1 13 B11R1.16 N#CCC(=O)C1=CC=CN=C1 W5295 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.16 N#CCC(=O)C1=CC=NC=C1 W4748 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.16 N#CCC(=O)C1=NC=CC=C1 V6511 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.16 N#C\C=C(/Cl)C1=CC=CC=C1 5314AH [0,0,0,0,0,0|3,0,1]=4 17 B11R1.16 NCCC(O)C1=CC=CC=C1 6964AB [0,0,0,0,0,0|2,0,2]=4 18 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [1,0,0,0,0,0|1,0,0]=2 19 B10R1.15 C=CC(=O)C1=CC=CC=C1 1968AC [1,0,0,0,0,0|0,0,2]=3 20 B10R1.15 C=CS(=O)C1=CC=CC=C1 0500AB [1,0,0,0,0,0|1,0,2]=4 21 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.15 CCC(=O)C1=CC=CN=C1 Y5018 [1,0,0,0,0,0|1,0,0]=2 24 B10R1.15 CCC(=O)C1=NC=CC=C1 Y6177 [1,0,0,0,0,0|1,0,0]=2 25 B10R1.15 CCC(N)C1=CC=NC=C1 4998AJ [1,0,0,0,0,0|2,0,1]=4 26 B10R1.15 CCC(N)C1=NC=CC=C1 4914AJ [1,0,0,0,0,0|2,0,1]=4 27 B10R1.15 CCN(C)C1=CC=CC=C1 W7366 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.15 CCN(C)C1=CC=CC=N1 5048AL [1,0,0,0,0,0|3,0,0]=4 29 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [1,0,0,0,0,0|2,0,0]=3 30 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [1,0,0,0,0,0|0,0,2]=3 31 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [1,0,0,0,0,0|2,0,1]=4 32 B10R1.15 COC(=N)C1=CC=NC=C1 4422AB [1,0,0,0,0,0|2,0,0]=3 33 B10R1.15 COC(=N)C1=NC=CC=C1 3585AL [1,0,0,0,0,0|2,0,0]=3 34 B10R1.15 COC(=O)C1=CC=NN=C1 W5569 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.15 COS(=O)C1=CC=CC=C1 0314AC [1,0,0,0,0,0|1,0,0]=2 36 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [1,0,0,0,0,0|2,0,1]=4 38 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [1,0,0,0,0,0|1,0,2]=4 39 B10R1.15 N\C(=N/O)C1=CC=CC=C1 3148AL [1,0,0,0,0,0|3,0,0]=4 40 B10R1.15 O=C(CBr)C1=CC=CC=N1 5318AB [1,0,0,0,0,0|2,0,0]=3 41 B10R1.15 O=C(CBr)C1=CC=CN=C1 C113 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7120AL [1,0,0,0,0,0|2,0,0]=3 43 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7846AF [1,0,0,0,0,0|2,0,0]=3 44 B10R1.15 O=C(O[Ag])C1=CC=CC=C1 7828AF [1,0,0,0,0,0|1,0,0]=2 45 B10R1.17 BrCCSC1=CC=CC=C1 5534AL [1,0,0,0,0,0|3,0,0]=4 46 B10R1.17 C=COCC1=CC=CC=C1 1335AL [1,0,0,0,0,0|0,0,3]=4 47 B10R1.17 CCOCC1=CC=CC=C1 S562 [1,0,0,0,0,0|0,0,1]=2 48 B10R1.17 COCSC1=CC=CC=C1 8208AL [1,0,0,0,0,0|3,0,0]=4 49 B10R1.17 ClCC#CC1=CC=CC=C1 U705 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.17 ClCSCC1=CC=CC=C1 2470AE [1,0,0,0,0,0|1,1,1]=4 51 B10R1.17 OCCNC1=CC=CC=C1 V7623 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 V6195 [0,1,0,0,0,0|1,0,0]=2 53 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 5727AB [0,1,0,0,0,0|1,0,0]=2 54 B12R1.16 CCCC(=O)C1=CC=C(Cl)C=C1 V1725 [0,1,0,0,0,0|1,0,0]=2 55 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 8631AA [0,1,0,0,0,0|1,0,0]=2 56 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 X9684 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.16 CCNC(=O)C1=CC=C(Br)C=C1 V5867 [0,1,0,0,0,0|1,0,0]=2 58 B12R1.16 CCNC(=O)C1=CC=C(F)C=C1 V7708 [0,1,0,0,0,0|1,0,0]=2 59 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 1026AB [0,1,0,0,0,0|1,0,0]=2 60 B12R1.16 CCOC(=O)C1=CC=C(N)C=N1 3426AA [0,1,0,0,0,0|1,0,0]=2 61 B12R1.16 CCOC(=O)C1=CN=C(C)C=N1 5635AB [0,1,0,0,0,0|2,0,0]=3 62 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 Z2244 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 W8383 [0,1,0,0,0,0|1,0,0]=2 64 B12R1.16 CCOC(=O)C1=NC=C(Br)N=C1 W5756 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.16 CCOC(=O)C1=NC=C(Cl)N=C1 Z4851 [0,1,0,0,0,0|2,0,0]=3 66 B12R1.16 CCOC(=O)C1=NN=C(Cl)C=C1 W8288 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.16 CCOC(=O)C1=NN=C(N)C=C1 V9915 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.16 CCOC(=O)C1=NN=C(O)C=C1 W7504 [0,1,0,0,0,0|2,0,0]=3 69 B12R1.16 N#CCC(=O)C1=CC=C(Br)C=C1 V6040 [0,1,0,0,0,0|2,0,1]=4 70 B12R1.17 CCNC(=O)C1=CC=CC(Br)=C1 V4803 [0,1,0,0,0,0|1,0,0]=2 71 B12R1.17 CCNC(=O)C1=CC=CC(F)=C1 V3438 [0,1,0,0,0,0|1,0,0]=2 72 B12R1.17 CCNC(=O)C1=CN=CC(Br)=C1 V3798 [0,1,0,0,0,0|2,0,0]=3 73 B12R1.17 CCOC(=O)C1=CC(=O)C=CO1 7791AA [0,1,0,0,0,0|1,0,0]=2 74 B12R1.17 CCOC(=O)C1=CC(=O)NC=N1 Y5350 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.17 CCOC(=O)C1=CC(Br)=NC=C1 Z5307 [0,1,0,0,0,0|1,0,0]=2 76 B12R1.17 CCOC(=O)C1=CC(C)=CN=C1 0656AB [0,1,0,0,0,0|1,0,0]=2 77 B12R1.17 CCOC(=O)C1=CC(C)=NC=C1 2111AB [0,1,0,0,0,0|1,0,0]=2 78 B12R1.17 CCOC(=O)C1=CC=CC(C)=C1 D344 [0,1,0,0,0,0|0,0,0]=1 79 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 K582 [0,1,0,0,0,0|0,0,0]=1 80 B12R1.17 CCOC(=O)C1=CC=NC(Cl)=N1 3372AA [0,1,0,0,0,0|2,0,0]=3 81 B12R1.17 CCOC(=O)C1=CN=CC(Cl)=C1 0655AB [0,1,0,0,0,0|1,0,0]=2 82 B12R1.17 CCOC(=O)C1=CN=CC(F)=C1 1379AB [0,1,0,0,0,0|1,0,0]=2 83 B12R1.17 CCOC(=O)C1=CN=CC(O)=C1 8819AB [0,1,0,0,0,0|1,0,0]=2 84 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 W7903 [0,1,0,0,0,0|1,0,0]=2 85 B12R1.17 N#CCC(=O)C1=CC=CC(Br)=C1 Y6359 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.17 N#CCC(=O)C1=CC=CC(F)=C1 Z2099 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.30 C#CCOC(=O)C1=CC=CC=C1 0383AC [0,1,0,0,0,0|0,0,1]=2 88 B12R1.30 C=CCOC(=O)C1=CC=CC=C1 7028AL [0,1,0,0,0,0|0,0,1]=2 89 B12R1.30 CCCCC(=O)C1=NC=CC=C1 V7440 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.30 CCCCC(O)C1=CC=CC=C1 8631AB [0,1,0,0,0,0|1,0,2]=4 91 B12R1.30 CCCCN(N)C1=CC=CC=C1 4924AL [0,1,0,0,0,0|3,0,0]=4 92 B12R1.30 CCCNC(C)C1=CC=CC=C1 4612AD [0,1,0,0,0,0|2,0,1]=4 93 B12R1.30 N#CCCC(=O)C1=CC=CC=C1 5672AH [0,1,0,0,0,0|1,0,1]=3 94 B12R1.30 NCCNC(=O)C1=CC=NC=C1 5908AD [0,1,0,0,0,0|2,0,0]=3 95 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 2341AB [0,1,0,0,0,0|1,0,0]=2 96 B12R1.30 O=C(NCCO)C1=CN=CC=C1 W7469 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.30 O=C(OCCI)C1=CC=CC=C1 5662AL [0,1,0,0,0,0|0,0,0]=1 98 B12R1.34 C=C(C(=O)OC)C1=CC=CC=C1 9744AA [0,1,0,0,0,0|3,0,0]=4 99 B12R1.39 CCNS(=O)(=O)C1=CC=CN=C1 V6137 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.39 COCS(=O)(=O)C1=CC=CC=C1 8209AL [0,1,0,0,0,0|3,0,0]=4 101 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 V5661 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 8629AB [0,1,0,0,0,0|1,0,0]=2 103 B12R1.308 CCNC(=O)C1=CC=CC=C1Br V7815 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.308 CCOC(=O)C1=C(Br)C=NC=N1 6791AJ [0,1,0,0,0,0|2,0,0]=3 105 B12R1.308 CCOC(=O)C1=C(Br)N=CC=C1 Y9350 [0,1,0,0,0,0|1,0,0]=2 106 B12R1.308 CCOC(=O)C1=C(Cl)N=CN=C1 W6159 [0,1,0,0,0,0|2,0,0]=3 107 B12R1.308 CCOC(=O)C1=C(N)N=CN=C1 9978AB [0,1,0,0,0,0|2,0,0]=3 108 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl W3804 [0,1,0,0,0,0|1,0,0]=2 109 B12R1.308 CCOC(=O)C1=CN=CN=C1C 2017AA [0,1,0,0,0,0|2,0,0]=3 110 B12R1.308 CCOC(=O)C1=NC=CC=C1Br 6006AB [0,1,0,0,0,0|1,0,0]=2 111 B12R1.308 CCOC(=O)C1=NC=CC=C1C Y3303 [0,1,0,0,0,0|1,0,0]=2 112 B12R1.308 CCOC(=O)C1=NC=CC=C1N Z4538 [0,1,0,0,0,0|1,0,0]=2 113 B12R1.308 N#CCC(=O)C1=CC=CC=C1Br W6817 [0,1,0,0,0,0|2,0,1]=4 114 B12R1.308 O=C(CCCl)C1=CC=CC=C1F V8855 [0,1,0,0,0,0|2,0,0]=3 115 B12R2.2 C1=CC=C(C2=CC=NO2)C=C1 5903AH [0,0,0,1,0,0|2,0,1]=4 116 B12R2.2 C1=CC=C(C2=NN=CO2)C=C1 2762AC [0,0,0,1,0,0|2,0,1]=4 117 B12R2.2 C1=CC=C(C2SCCS2)C=C1 2161AL [0,0,0,1,0,0|0,2,1]=4 118 B12R2.2 C1=CN=CC(C2=NCCC2)=C1 5048AE [0,0,0,1,0,0|3,0,0]=4 119 B12R2.116 NC1(C2=CC=CC=C2)CCC1 Z3969 [0,0,0,1,0,0|2,0,1]=4 120 B12R2.1081 CC1=NCCC2=C1C=CC=C2 Z2315 [0,0,0,1,0,0|2,0,0]=3 121 B12R2.1081 CC1NCCC2=C1C=CC=C2 X8977 [0,0,0,1,0,0|2,0,1]=4 122 B12R2.1081 CN1CCCC2=C1C=CC=C2 6666AB [0,0,0,1,0,0|3,0,0]=4 123 B12R2.1081 NN1CCCC2=C1C=CC=C2 6035AE [0,0,0,1,0,0|3,0,0]=4 124 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 B573 [0,0,0,1,0,0|2,0,1]=4 125 B12R2.1081 O=C1CCCC2=C1C=CC=N2 Y6538 [0,0,0,1,0,0|2,0,0]=3 126 B12R2.1081 O=C1CCCC2=C1C=NC=C2 3377AJ [0,0,0,1,0,0|2,0,0]=3 127 B12R2.1081 O=C1CCNC2=C1C=CC=C2 W8031 [0,0,0,1,0,0|2,0,0]=3 128 B12R2.1081 O=C1COCC2=C1C=CC=C2 W4380 [0,0,0,1,0,0|2,0,0]=3 129 B12R2.1081 O=C1CSCC2=C1C=CC=C2 X5478 [0,0,0,1,0,0|2,0,0]=3 130 B12R2.1081 O=C1NCCC2=C1C=CC=C2 X9392 [0,0,0,1,0,0|1,0,0]=2 131 B12R2.1081 O=C1NCCC2=C1N=CC=C2 Y3276 [0,0,0,1,0,0|2,0,0]=3 132 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 V1329 [0,0,0,1,0,0|1,0,2]=4 133 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 9076AB [0,0,0,1,0,0|1,0,0]=2 134 B12R2.2028 CN1N=C(I)C2=C1C=CC=C2 Y9322 [0,0,0,1,0,0|3,0,0]=4 135 B12R2.2028 CN1N=C(N)C2=C1C=CC=C2 Y5484 [0,0,0,1,0,0|3,0,0]=4 136 B12R2.2028 NC1CC(=O)C2=CC=CC=C21 4741AD [0,0,0,1,0,0|2,0,0]=3 137 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 5276AB [0,0,0,1,0,0|2,0,1]=4 138 B12R2.2075 N[C@@H](C1=CC=CC=C1)C2CC2 W9898 [0,0,0,1,0,0|2,0,1]=4 139 B10R1.11 CCCC(=O)C1=CC=CS1 Z5535 [0,0,0,0,1,0|2,0,0]=3 140 B10R1.11 CCOC(=O)C1=CC=NN1 0764AB [0,0,0,0,1,0|2,0,0]=3 141 B10R1.11 CCOC(=O)C1=CN=CS1 W5468 [0,0,0,0,1,0|2,0,0]=3 142 B10R1.11 CCOC(=O)C1=CNN=N1 Z4712 [0,0,0,0,1,0|3,0,0]=4 143 B10R1.11 CCOC(=O)C1=CSC=C1 Z3445 [0,0,0,0,1,0|1,0,0]=2 144 B10R1.11 CCOC(=O)C1=CSC=N1 Y5283 [0,0,0,0,1,0|2,0,0]=3 145 B10R1.11 CCOC(=O)C1=NC=CO1 W5476 [0,0,0,0,1,0|2,0,0]=3 146 B10R1.11 CCOC(=O)C1=NC=CS1 Y7549 [0,0,0,0,1,0|2,0,0]=3 147 B10R1.11 CCOC(=O)C1=NOC=C1 X5534 [0,0,0,0,1,0|2,0,0]=3 148 B10R1.11 CCOC(=O)C1=NOC=N1 6635AJ [0,0,0,0,1,0|3,0,0]=4 149 B10R1.11 CCOC(=O)N1C=CN=C1 7686AF [0,0,0,0,1,0|2,0,0]=3 150 B12R1.32 CCCC(=O)CC1=CC=CC=C1 U242 [0,0,0,0,0,1|1,0,0]=2 151 B12R1.32 CCOC(=O)CC1=NC=CC=N1 W7517 [0,0,0,0,0,1|2,0,0]=3 152 B12R1.32 CCSC(=S)NC1=CC=CC=N1 5795AL [0,0,0,0,0,1|1,2,0]=4 153 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 2406AL [0,0,0,0,0,1|2,0,0]=3 154 B9R1.6 CC(=O)C1=CC=NC=N1 W6021 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.6 CC(=O)C1=CC=NN=C1 W6606 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.6 CC(=O)C1=CN=CN=C1 X8651 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.6 CC(=O)C1=NC=CC=N1 7575AB [2,0,0,0,0,0|2,0,0]=4 158 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [2,0,0,0,0,0|2,0,0]=4 159 B9R1.6 O=C(F)C1=CC=CC=C1 3921AE [2,0,0,0,0,0|1,0,0]=3 160 B9R1.6 O=C(O)C1=NC=CC=C1 7630AF [2,0,0,0,0,0|1,0,0]=3 161 B9R1.6 O=C(O)C1=NN=CC=C1 X0237 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.6 O=C([O-])C1=CC=NC=C1 8981AL [2,0,0,0,0,0|1,0,1]=4 163 B9R1.8 C=COC1=CC=CC=C1 1277AQ [2,0,0,0,0,0|0,0,2]=4 164 B9R1.8 CC#CC1=CC=CC=C1 4952AL [2,0,0,0,0,0|0,0,2]=4 165 B9R1.8 CCCC1=NC=CC=C1 C946 [2,0,0,0,0,0|1,0,1]=4 166 B9R1.8 CCNC1=CC=CC=N1 5047AL [2,0,0,0,0,0|2,0,0]=4 167 B9R1.8 CCOC1=NN=CC=C1 W7464 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.8 COCC1=CC=CN=C1 5231AH [2,0,0,0,0,0|1,0,1]=4 169 B9R1.8 COCC1=CC=NC=C1 5493AH [2,0,0,0,0,0|1,0,1]=4 170 B9R1.8 COCC1=NC=CC=C1 V2195 [2,0,0,0,0,0|1,0,1]=4 171 B9R1.8 CSCC1=CC=CC=C1 7914AF [2,0,0,0,0,0|0,1,1]=4 172 B9R1.8 C\C=C/C1=CC=CC=C1 7457AL [2,0,0,0,0,0|0,0,1]=3 173 B9R1.8 C\N=C\C1=CC=CC=C1 R179 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.8 ICCC1=CC=CC=C1 4037AL [2,0,0,0,0,0|1,0,1]=4 175 B9R1.8 N#COC1=CC=CC=C1 3790AL [2,0,0,0,0,0|1,0,1]=4 176 B9R1.8 NCCC1=CC=CC=C1 5784AL [2,0,0,0,0,0|1,0,1]=4 177 B9R1.8 N\N=C\C1=CC=CC=C1 7871AF [2,0,0,0,0,0|2,0,0]=4 178 B9R1.8 OCCC1=CC=CC=C1 V0900 [2,0,0,0,0,0|1,0,1]=4 179 B11R1.7 CCC(C)(C)C1=CC=CC=C1 0523AB [1,1,0,0,0,0|1,0,1]=4 180 B11R1.7 CCS(=N)(=O)C1=CC=CC=C1 9057AJ [1,1,0,0,0,0|1,0,0]=3 181 B11R1.7 O=S(=O)(CF)C1=CC=CC=C1 0643AB [1,1,0,0,0,0|2,0,0]=4 182 B11R1.12 CCN(CC)C1=CC=CC=C1 5729AF [1,1,0,0,0,0|2,0,0]=4 183 B11R1.12 CCN(CC)C1=CC=CC=C1 8878AJ [1,1,0,0,0,0|2,0,0]=4 184 B11R1.12 CCN(N=O)C1=CC=CC=C1 8933AJ [1,1,0,0,0,0|1,0,0]=3 185 B11R1.12 CCP(CC)C1=CC=CC=C1 8571AJ [1,1,0,0,0,0|2,0,0]=4 186 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 9242AA [1,1,0,0,0,0|0,0,2]=4 187 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 5639AH [1,1,0,0,0,0|1,0,1]=4 188 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 Z5095 [1,1,0,0,0,0|1,0,1]=4 189 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 1635AE [1,1,0,0,0,0|2,0,0]=4 190 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 9145AE [1,1,0,0,0,0|1,0,1]=4 191 B11R1.22 CCN(C)C1=CC=C(N)C=C1 9950AH [1,1,0,0,0,0|2,0,0]=4 192 B11R1.22 CNC(=O)C1=CC=C(Cl)N=C1 5281AE [1,1,0,0,0,0|2,0,0]=4 193 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 4844AB [1,1,0,0,0,0|1,0,0]=3 194 B11R1.22 COC(=O)C1=CN=C(O)C=C1 W7719 [1,1,0,0,0,0|1,0,0]=3 195 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 W9246 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 W4394 [1,1,0,0,0,0|2,0,0]=4 197 B11R1.22 COC(=O)C1=NC=C(C)C=C1 W5212 [1,1,0,0,0,0|1,0,0]=3 198 B11R1.22 COC(=O)C1=NC=C(F)C=C1 Z7177 [1,1,0,0,0,0|1,0,0]=3 199 B11R1.22 COC(=O)C1=NC=C(N)C=C1 W7797 [1,1,0,0,0,0|1,0,0]=3 200 B11R1.22 COC(=O)C1=NC=C(N)N=C1 W3046 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.22 COC(=O)C1=NC=C(O)C=C1 W5304 [1,1,0,0,0,0|1,0,0]=3 202 B11R1.22 COC(=O)C1=NC=C(O)N=C1 W3047 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.22 COC(=O)C1=NN=C(C)C=C1 1449AA [1,1,0,0,0,0|2,0,0]=4 204 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 W7653 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.22 COC(=O)C1=NN=C(N)C=C1 V9902 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.22 COC(=O)C1=NNC(=O)C=C1 W7503 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.22 N#CC(=O)C1=CC=C(Cl)C=C1 5602AH [1,1,0,0,0,0|1,0,1]=4 208 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 Y5103 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 L165 [1,1,0,0,0,0|1,0,0]=3 210 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 W8329 [1,1,0,0,0,0|1,0,0]=3 211 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 X8275 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 0082AE [1,1,0,0,0,0|1,0,0]=3 213 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 5413AB [1,1,0,0,0,0|1,0,0]=3 214 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 Z3623 [1,1,0,0,0,0|1,0,1]=4 215 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 7236AB [1,1,0,0,0,0|0,0,0]=2 216 B11R1.23 CCN(N)C1=CC=CC(C)=C1 4837AL [1,1,0,0,0,0|2,0,0]=4 217 B11R1.23 CNC(=O)C1=CC(Cl)=NC=C1 Z9574 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 V6197 [1,1,0,0,0,0|1,0,0]=3 219 B11R1.23 CNC(=O)C1=CC=CC(F)=C1 V7378 [1,1,0,0,0,0|1,0,0]=3 220 B11R1.23 COC(=O)C1=CC(=O)NC=C1 W9272 [1,1,0,0,0,0|1,0,0]=3 221 B11R1.23 COC(=O)C1=CC(C)=CC=N1 6274AA [1,1,0,0,0,0|1,0,0]=3 222 B11R1.23 COC(=O)C1=CC(C)=NC=C1 8594AA [1,1,0,0,0,0|1,0,0]=3 223 B11R1.23 COC(=O)C1=CC(C)=NC=N1 1480AC [1,1,0,0,0,0|2,0,0]=4 224 B11R1.23 COC(=O)C1=CC(F)=NC=C1 Z6058 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.23 COC(=O)C1=CC(I)=NC=C1 Z9814 [1,1,0,0,0,0|1,0,0]=3 226 B11R1.23 COC(=O)C1=CC(O)=NC=N1 7127AJ [1,1,0,0,0,0|2,0,0]=4 227 B11R1.23 COC(=O)C1=CC=CC(N)=C1 3819AC [1,1,0,0,0,0|0,0,0]=2 228 B11R1.23 COC(=O)C1=CC=C[N+]([O-])=C1 5036AD [1,1,0,0,0,0|1,0,0]=3 229 B11R1.23 COC(=O)C1=CN=CC(F)=C1 V6033 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.23 COC(=O)C1=CN=CC(N)=C1 4299AJ [1,1,0,0,0,0|1,0,0]=3 231 B11R1.23 COC(=O)C1=NC(=O)NC=C1 6326AC [1,1,0,0,0,0|2,0,0]=4 232 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 W6055 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 3663AA [1,1,0,0,0,0|2,0,0]=4 234 B11R1.23 COC(=O)C1=NC(C)=CN=C1 7130AJ [1,1,0,0,0,0|2,0,0]=4 235 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 W3275 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.23 COC(=O)C1=NC(N)=CN=C1 X9326 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 W3865 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.23 COC(=O)C1=NC=CC(F)=C1 V8670 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.23 COC(=O)C1=NC=CC(I)=C1 V5601 [1,1,0,0,0,0|1,0,0]=3 240 B11R1.23 COC(=O)C1=NC=CC(O)=C1 V6083 [1,1,0,0,0,0|1,0,0]=3 241 B11R1.23 N#CC(=O)C1=CC(Br)=CC=C1 5306AH [1,1,0,0,0,0|1,0,1]=4 242 B11R1.23 N#CC(=O)C1=CC=CC(Cl)=C1 5318AH [1,1,0,0,0,0|1,0,1]=4 243 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AB [1,1,0,0,0,0|2,0,0]=4 244 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AC [1,1,0,0,0,0|2,0,0]=4 245 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 V6203 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 2340AE [1,1,0,0,0,0|2,0,0]=4 247 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 Y1217 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 Y7249 [1,1,0,0,0,0|1,0,1]=4 249 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 V6832 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.36 CC(C)C(O)C1=CC=CC=C1 9149AB [1,1,0,0,0,0|0,0,2]=4 251 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 7205AB [1,1,0,0,0,0|1,0,1]=4 252 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 W7886 [1,1,0,0,0,0|1,0,1]=4 253 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 5584AL [1,1,0,0,0,0|0,0,0]=2 254 B11R1.36 O=C(C1=NC=CC=C1)C(F)F 2534AC [1,1,0,0,0,0|2,0,0]=4 255 B11R1.222 CCC(=O)C1=CC=CC=C1C V4211 [1,1,0,0,0,0|0,0,0]=2 256 B11R1.222 CCC(=O)C1=CC=CC=C1Cl Z4973 [1,1,0,0,0,0|0,0,0]=2 257 B11R1.222 CCN(N)C1=C(C)C=CC=C1 4838AL [1,1,0,0,0,0|2,0,0]=4 258 B11R1.222 CNC(=O)C1=C(F)C=CC=C1 2080AL [1,1,0,0,0,0|1,0,0]=3 259 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 5571AJ [1,1,0,0,0,0|1,0,0]=3 260 B11R1.222 CNC(=O)C1=C(O)C=CC=N1 2289AJ [1,1,0,0,0,0|2,0,0]=4 261 B11R1.222 CNC(=O)C1=CC=CC=C1S 0033AP [1,1,0,0,0,0|1,0,0]=3 262 B11R1.222 CNC(=O)C1=CC=CN=C1Cl 5008AE [1,1,0,0,0,0|2,0,0]=4 263 B11R1.222 CNC(=O)C1=CC=CN=C1N 3745AC [1,1,0,0,0,0|2,0,0]=4 264 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 Y3316 [1,1,0,0,0,0|1,0,0]=3 265 B11R1.222 COC(=O)C1=C(F)C=NC=C1 Y3317 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.222 COC(=O)C1=C(I)C=NC=C1 W4067 [1,1,0,0,0,0|1,0,0]=3 267 B11R1.222 COC(=O)C1=C(I)N=CC=C1 V9048 [1,1,0,0,0,0|1,0,0]=3 268 B11R1.222 COC(=O)C1=C(N)N=CN=C1 W8049 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.222 COC(=O)C1=C(O)C=NC=C1 X8555 [1,1,0,0,0,0|1,0,0]=3 270 B11R1.222 COC(=O)C1=C(O)N=CC=C1 W7787 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.222 COC(=O)C1=CC=CN=C1Br Z0661 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.222 COC(=O)C1=CC=COC1=O 8572AD [1,1,0,0,0,0|1,0,0]=3 273 B11R1.222 COC(=O)C1=CN=CC=C1C X4936 [1,1,0,0,0,0|1,0,0]=3 274 B11R1.222 COC(=O)C1=NC=CC=C1Br X8327 [1,1,0,0,0,0|1,0,0]=3 275 B11R1.222 COC(=O)C1=NC=CC=C1F V8242 [1,1,0,0,0,0|1,0,0]=3 276 B11R1.222 COC(=O)C1=NC=CC=C1N W5753 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.222 COC(=O)C1=NC=CN=C1C Z4722 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.222 N#CC(=O)C1=C(Cl)C=CC=C1 1673AJ [1,1,0,0,0,0|1,0,1]=4 279 B11R1.222 N#CC(=O)C1=CC=CC=C1F V7828 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.222 NCC(=O)C1=CC=CC=C1F W9587 [1,1,0,0,0,0|1,0,0]=3 281 B11R1.222 NNC(=O)C1=CC=CC=C1Br 9319AD [1,1,0,0,0,0|2,0,0]=4 282 B11R1.222 O=C(CBr)C1=CC=CC=C1F V7141 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.1 CCCCC1=CC=C(Cl)C=C1 4800AL [1,1,0,0,0,0|1,0,1]=4 284 B11R1.1 CCCOC1=CC=C(Br)C=C1 Z0571 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.1 CCNCC1=CC=C(Cl)C=C1 7274AJ [1,1,0,0,0,0|1,0,1]=4 286 B11R1.1 CCNCC1=CC=C(Cl)C=C1 7613AC [1,1,0,0,0,0|1,0,1]=4 287 B11R1.1 N(CC)CC1=CC=C(F)C=C1 7275AJ [1,1,0,0,0,0|1,0,1]=4 288 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 8226AC [1,1,0,0,0,0|2,0,0]=4 289 B11R1.17 CCCNC1=C(Cl)C=CC=C1 8047AB [1,1,0,0,0,0|2,0,0]=4 290 B11R1.17 CCCOC1=CC=CC=C1F V4197 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.17 CCCOC1=CC=CC=C1O 9496AB [1,1,0,0,0,0|2,0,0]=4 292 B11R1.24 CCCOC1=CC(Br)=CC=C1 Z0201 [1,1,0,0,0,0|2,0,0]=4 293 B11R1.24 CCCOC1=CC(C)=CC=C1 V5255 [1,1,0,0,0,0|2,0,0]=4 294 B11R1.24 CCNCC1=CC(O)=CC=C1 5753AJ [1,1,0,0,0,0|1,0,1]=4 295 B11R1.24 CCNCC1=CC=CC(Br)=C1 7269AJ [1,1,0,0,0,0|1,0,1]=4 296 B11R1.24 CCNCC1=CC=CC(F)=C1 V8908 [1,1,0,0,0,0|1,0,1]=4 297 B11R1.24 CCOCC1=CC(Cl)=CC=C1 V7289 [1,1,0,0,0,0|0,0,1]=3 298 B11R1.28 C=CCOCC1=CC=CC=C1 3133AL [1,1,0,0,0,0|0,0,2]=4 299 B11R1.28 CCCC#CC1=CC=CC=C1 4951AL [1,1,0,0,0,0|1,0,1]=4 300 B11R1.28 CNCCOC1=CC=CC=C1 0730AF [1,1,0,0,0,0|2,0,0]=4 301 B11R1.28 ClCCCCC1=CC=CC=C1 4817AL [1,1,0,0,0,0|1,0,1]=4 302 B11R1.28 NCCCCC1=CC=CC=C1 9681AD [1,1,0,0,0,0|1,0,1]=4 303 B11R1.28 OCCCNC1=CC=CC=C1 5828AL [1,1,0,0,0,0|2,0,0]=4 304 B11R1.91 C=C(C)OCC1=CC=CC=C1 7143AL [1,1,0,0,0,0|0,0,2]=4 305 B11R1.91 CC(C)CCC1=CC=CC=C1 5880AF [1,1,0,0,0,0|1,0,1]=4 306 B11R1.15 CCCC(=O)C1=CC=C(C)S1 9890AE [0,1,0,0,1,0|2,0,0]=4 307 B11R1.15 CCOC(=O)C1=CC(Br)=CN1 3377AL [0,1,0,0,1,0|1,0,0]=3 308 B11R1.15 CCOC(=O)C1=CC(Br)=CS1 9351AB [0,1,0,0,1,0|1,0,0]=3 309 B11R1.15 CCOC(=O)C1=CC(Br)=NO1 X8739 [0,1,0,0,1,0|2,0,0]=4 310 B11R1.15 CCOC(=O)C1=CC(Cl)=CS1 Z4921 [0,1,0,0,1,0|1,0,0]=3 311 B11R1.15 CCOC(=O)C1=CC(N)=CN1 Z2805 [0,1,0,0,1,0|1,0,0]=3 312 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 X7026 [0,1,0,0,1,0|1,0,0]=3 313 B11R1.15 CCOC(=O)C1=CC=C(N)N1 W8281 [0,1,0,0,1,0|1,0,0]=3 314 B11R1.15 CCOC(=O)C1=CN(C)C=N1 W6184 [0,1,0,0,1,0|2,0,0]=4 315 B11R1.15 CCOC(=O)C1=CN=C(Br)O1 X8791 [0,1,0,0,1,0|2,0,0]=4 316 B11R1.15 CCOC(=O)C1=CN=C(Cl)O1 Y5588 [0,1,0,0,1,0|2,0,0]=4 317 B11R1.15 CCOC(=O)C1=CN=C(Cl)S1 W8583 [0,1,0,0,1,0|2,0,0]=4 318 B11R1.15 CCOC(=O)C1=CN=C(N)N1 W3259 [0,1,0,0,1,0|2,0,0]=4 319 B11R1.15 CCOC(=O)C1=CN=C(N)O1 X9073 [0,1,0,0,1,0|2,0,0]=4 320 B11R1.15 CCOC(=O)C1=CNC(S)=N1 Y9698 [0,1,0,0,1,0|2,0,0]=4 321 B11R1.15 CCOC(=O)C1=CSC(Cl)=N1 9712AF [0,1,0,0,1,0|2,0,0]=4 322 B11R1.15 CCOC(=O)C1=CSC(Cl)=N1 W6195 [0,1,0,0,1,0|2,0,0]=4 323 B11R1.15 CCOC(=O)C1=CSC(N)=N1 3350AE [0,1,0,0,1,0|2,0,0]=4 324 B11R1.15 CCOC(=O)C1=NNC(Br)=C1 6746AA [0,1,0,0,1,0|2,0,0]=4 325 B11R1.29 CCCOC(=O)C1=CC=CO1 5636AL [0,1,0,0,1,0|1,0,0]=3 326 B11R1.29 CNCCC(=O)C1=CC=CS1 Z2651 [0,1,0,0,1,0|2,0,0]=4 327 B11R1.199 CCNC(=O)C1=CC=CN1C 4708AA [0,1,0,0,1,0|2,0,0]=4 328 B11R1.199 CCOC(=O)C1=C(Br)N=CO1 X9645 [0,1,0,0,1,0|2,0,0]=4 329 B11R1.199 CCOC(=O)C1=C(Br)N=CS1 W3323 [0,1,0,0,1,0|2,0,0]=4 330 B11R1.199 CCOC(=O)C1=C(C)C=CN1 W5456 [0,1,0,0,1,0|1,0,0]=3 331 B11R1.199 CCOC(=O)C1=C(C)N=CO1 W4308 [0,1,0,0,1,0|2,0,0]=4 332 B11R1.199 CCOC(=O)C1=C(C)NN=C1 3461AC [0,1,0,0,1,0|2,0,0]=4 333 B11R1.199 CCOC(=O)C1=C(C)OC=N1 Y8737 [0,1,0,0,1,0|2,0,0]=4 334 B11R1.199 CCOC(=O)C1=C(C)SC=C1 W4150 [0,1,0,0,1,0|1,0,0]=3 335 B11R1.199 CCOC(=O)C1=C(C)SC=N1 W7359 [0,1,0,0,1,0|2,0,0]=4 336 B11R1.199 CCOC(=O)C1=C(Cl)C=CS1 4776AD [0,1,0,0,1,0|1,0,0]=3 337 B11R1.199 CCOC(=O)C1=C(Cl)NN=C1 6289AC [0,1,0,0,1,0|2,0,0]=4 338 B11R1.199 CCOC(=O)C1=C(N)C=CS1 3485AB [0,1,0,0,1,0|1,0,0]=3 339 B11R1.199 CCOC(=O)C1=C(N)C=NN1 W6978 [0,1,0,0,1,0|2,0,0]=4 340 B11R1.199 CCOC(=O)C1=C(N)ON=C1 Z3178 [0,1,0,0,1,0|2,0,0]=4 341 B11R1.199 CCOC(=O)C1=C(N)SC=N1 9849AA [0,1,0,0,1,0|2,0,0]=4 342 B11R1.199 CCOC(=O)C1=C(O)ON=C1 W6545 [0,1,0,0,1,0|2,0,0]=4 343 B11R1.199 CCOC(=O)C1=CC=CN1C Z3145 [0,1,0,0,1,0|1,0,0]=3 344 B11R1.199 CCOC(=O)C1=CC=NN1C 8631AJ [0,1,0,0,1,0|2,0,0]=4 345 B11R1.199 CCOC(=O)C1=CN=CN1C 0254AC [0,1,0,0,1,0|2,0,0]=4 346 B11R1.199 CCOC(=O)C1=CNN=C1C Y5579 [0,1,0,0,1,0|2,0,0]=4 347 B11R1.199 CCOC(=O)C1=CNNC1=O 8740AE [0,1,0,0,1,0|2,0,0]=4 348 B11R1.199 CCOC(=O)C1=NC=CN1C W5258 [0,1,0,0,1,0|2,0,0]=4 349 B11R1.199 CCOC(=O)C1=NNC=C1Br 8835AB [0,1,0,0,1,0|2,0,0]=4 350 B11R1.199 CCOC(=O)C1=NNC=C1C Z4932 [0,1,0,0,1,0|2,0,0]=4 351 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 X6435 [0,1,0,0,0,1|0,0,0]=2 352 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 Y6942 [0,1,0,0,0,1|1,0,0]=3 353 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=N1 X9053 [0,1,0,0,0,1|2,0,0]=4 354 B13R1.19 CCOC(=O)NC1=CC=C(Cl)C=C1 8710AD [0,1,0,0,0,1|0,0,0]=2 355 B13R1.19 C\C=C\C(=O)OC1=CC=C(C)C=C1 7495AL [0,1,0,0,0,1|1,0,1]=4 356 B13R1.19 O=C(CCCl)NC1=CC=C(Br)C=C1 6475AD [0,1,0,0,0,1|2,0,0]=4 357 B13R1.20 CCOC(=O)CC1=CC(O)=CC=C1 6698AH [0,1,0,0,0,1|0,0,0]=2 358 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=N1 6464AC [0,1,0,0,0,1|1,0,0]=3 359 B13R1.20 CCOC(=O)CC1=CC=CC(F)=C1 8719AB [0,1,0,0,0,1|0,0,0]=2 360 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 8104AB [0,1,0,0,0,1|1,0,0]=3 361 B13R1.20 CCOC(=O)CC1=NC(N)=CC=C1 W8039 [0,1,0,0,0,1|1,0,0]=3 362 B13R1.20 CCOC(=O)NC1=CC=CC(Cl)=C1 W4462 [0,1,0,0,0,1|0,0,0]=2 363 B13R1.20 O=C(CCCl)NC1=CC(Cl)=CC=C1 4711AF [0,1,0,0,0,1|2,0,0]=4 364 B13R1.20 O=C(CCCl)NC1=CC(F)=CC=C1 7216AC [0,1,0,0,0,1|2,0,0]=4 365 B13R1.44 CCCCC(=O)CC1=CC=CC=C1 2160AB [0,1,0,0,0,1|1,0,0]=3 366 B13R1.44 CCCNC(=S)NC1=CC=CC=C1 3694AD [0,1,0,0,0,1|1,1,0]=4 367 B13R1.47 CCOC(=O)C(=O)C1=CC=CN=C1 W8172 [0,1,0,0,0,1|1,0,0]=3 368 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 Z8724 [0,1,0,0,0,1|1,0,0]=3 369 B13R1.47 CCOC(=O)[C@@H](N)C1=CC=CC=C1 V6822 [0,1,0,0,0,1|0,0,0]=2 370 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 U405 [0,1,0,0,0,1|1,0,0]=3 371 B13R1.470 CC1=CC=CC=C1NC(=O)CCCl 6553AD [0,1,0,0,0,1|2,0,0]=4 372 B13R1.470 CCNC(=O)CC1=CC=CC=C1Br Z7562 [0,1,0,0,0,1|1,0,0]=3 373 B13R1.470 CCOC(=O)CC1=C(Cl)N=CC=C1 5273AD [0,1,0,0,0,1|1,0,0]=3 374 B13R1.470 CCOC(=O)CC1=CN=CNC1=O 9334AB [0,1,0,0,0,1|2,0,0]=4 375 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br 0169AB [0,1,0,0,0,1|1,0,0]=3 376 B13R1.470 O=C(CCCl)NC1=CC=CC=C1F 1099AE [0,1,0,0,0,1|2,0,0]=4 377 B13R1.17 C#CCNC(=O)C1=CC=C(Br)C=C1 V7871 [0,2,0,0,0,0|1,0,1]=4 378 B13R1.17 C=CCOC(=O)C1=CC=C(O)C=C1 7027AL [0,2,0,0,0,0|0,0,1]=3 379 B13R1.17 CCCNC(=O)C1=CC=C(Br)C=C1 V4491 [0,2,0,0,0,0|1,0,0]=3 380 B13R1.17 CCCOC(=O)C1=CC=C(N)C=C1 5697AF [0,2,0,0,0,0|0,0,0]=2 381 B13R1.17 N#CCCC(=O)C1=CC=C(Br)C=C1 5438AH [0,2,0,0,0,0|1,0,1]=4 382 B13R1.17 O=C(CCCCl)C1=CC=C(Br)C=C1 6286AB [0,2,0,0,0,0|1,0,0]=3 383 B13R1.17 O=C(NCCO)C1=CC=C(Br)C=C1 8521AB [0,2,0,0,0,0|1,0,0]=3 384 B13R1.17 O=C(OCCO)C1=CC=C(O)C=C1 5656AL [0,2,0,0,0,0|0,0,0]=2 385 B13R1.21 COC(=O)C(=O)C1=CC=C(Br)C=C1 3509AL [0,2,0,0,0,0|2,0,0]=4 386 B13R1.21 COC(=O)C(=O)C1=CC=C(Cl)C=C1 3510AL [0,2,0,0,0,0|2,0,0]=4 387 B13R1.21 CON(C)C(=O)C1=CC=C(C)C=C1 4243AA [0,2,0,0,0,0|2,0,0]=4 388 B13R1.29 CCCS(=O)(=O)C1=CC=C(Br)C=C1 V4492 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.132 CC(=O)CC(=O)C1=CC=C(Br)C=C1 5378AB [0,2,0,0,0,0|1,0,1]=4 390 B13R1.132 CC(C)NC(=O)C1=CC=C(Br)C=C1 V5263 [0,2,0,0,0,0|1,0,0]=3 391 B13R1.132 CC(C)NC(=O)C1=CC=C(F)C=C1 V7366 [0,2,0,0,0,0|1,0,0]=3 392 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 V7724 [0,2,0,0,0,0|1,0,0]=3 393 B13R1.132 CC(C)OC(=O)C1=CC=C(N)C=C1 9513AA [0,2,0,0,0,0|0,0,0]=2 394 B13R1.452 C#CC1=CC=C(C(=O)OCC)C=C1 X6518 [0,2,0,0,0,0|0,0,0]=2 395 B13R1.452 CCCC(=O)C1=CC=C(OC)C=C1 2958AE [0,2,0,0,0,0|1,0,0]=3 396 B13R1.452 CCOC(=O)C1=CC=C(C=O)C=C1 Z2189 [0,2,0,0,0,0|0,0,0]=2 397 B13R1.452 CCOC(=O)C1=CC=C(CBr)C=C1 Z3173 [0,2,0,0,0,0|0,0,0]=2 398 B13R1.452 CCOC(=O)C1=CC=C(CBr)N=C1 W3888 [0,2,0,0,0,0|1,0,0]=3 399 B13R1.452 CCOC(=O)C1=CC=C(CN)C=C1 3372AL [0,2,0,0,0,0|0,0,0]=2 400 B13R1.452 CCOC(=O)C1=CC=C(NN)C=C1 7285AA [0,2,0,0,0,0|0,0,0]=2 401 B13R1.452 CCOC(=O)C1=CN=C(C#N)C=C1 W8320 [0,2,0,0,0,0|1,0,0]=3 402 B13R1.452 CCOC(=O)C1=NC=C(OC)N=C1 7744AB [0,2,0,0,0,0|2,0,0]=4 403 B13R1.466 CCCC(=O)C1=CC=C(Br)C(C)=C1 Z9334 [0,2,0,0,0,0|1,0,0]=3 404 B13R1.466 CCOC(=O)C1=CC(Br)=C(O)C=C1 1885AE [0,2,0,0,0,0|0,0,0]=2 405 B13R1.466 CCOC(=O)C1=CC(Cl)=C(Cl)C=C1 9114AD [0,2,0,0,0,0|0,0,0]=2 406 B13R1.466 CCOC(=O)C1=CC(Cl)=C(N)N=C1 9644AD [0,2,0,0,0,0|1,0,0]=3 407 B13R1.466 CCOC(=O)C1=CC(F)=C(Cl)C=C1 0434AB [0,2,0,0,0,0|0,0,0]=2 408 B13R1.466 CCOC(=O)C1=CC(I)=C(N)C=C1 X7015 [0,2,0,0,0,0|0,0,0]=2 409 B13R1.466 CCOC(=O)C1=CC(N)=C(C)N=C1 0276AA [0,2,0,0,0,0|1,0,0]=3 410 B13R1.466 CCOC(=O)C1=CC=C(Br)C(Cl)=N1 3843AA [0,2,0,0,0,0|1,0,0]=3 411 B13R1.466 CCOC(=O)C1=CC=C(Br)C(O)=N1 3851AA [0,2,0,0,0,0|1,0,0]=3 412 B13R1.466 CCOC(=O)C1=CC=C(F)C(Br)=C1 V4551 [0,2,0,0,0,0|0,0,0]=2 413 B13R1.466 CCOC(=O)C1=CC=C(I)C(Cl)=C1 1264AF [0,2,0,0,0,0|0,0,0]=2 414 B13R1.466 CCOC(=O)C1=CC=C(I)C(N)=C1 5041AA [0,2,0,0,0,0|0,0,0]=2 415 B13R1.466 CCOC(=O)C1=CC=C(N)C(Br)=C1 X5368 [0,2,0,0,0,0|0,0,0]=2 416 B13R1.466 CCOC(=O)C1=CC=C(N)C(Cl)=C1 2622AL [0,2,0,0,0,0|0,0,0]=2 417 B13R1.466 CCOC(=O)C1=CC=C(N)C(F)=C1 W8179 [0,2,0,0,0,0|0,0,0]=2 418 B13R1.466 CCOC(=O)C1=CC=C(O)C(N)=C1 6727AJ [0,2,0,0,0,0|0,0,0]=2 419 B13R1.466 CCOC(=O)C1=CN=C(N)C(Br)=C1 V8011 [0,2,0,0,0,0|1,0,0]=3 420 B13R1.466 CNCC(=O)C1=CC=C(O)C(O)=C1 8096AF [0,2,0,0,0,0|2,0,0]=4 421 B13R1.1511 CCOC(=O)C1=C(C)C=C(C)C=C1 6677AJ [0,2,0,0,0,0|0,0,0]=2 422 B13R1.1511 CCOC(=O)C1=C(C)NC(=O)C=C1 W5573 [0,2,0,0,0,0|1,0,0]=3 423 B13R1.1511 CCOC(=O)C1=C(Cl)C=C(N)C=C1 8076AA [0,2,0,0,0,0|0,0,0]=2 424 B13R1.1511 CCOC(=O)C1=C(F)C=C(Br)C=C1 6470AB [0,2,0,0,0,0|0,0,0]=2 425 B13R1.1511 CCOC(=O)C1=CC=C(C)N=C1C 8847AA [0,2,0,0,0,0|1,0,0]=3 426 B13R1.1511 CCOC(=O)C1=CC=C(Cl)C=C1Br V7305 [0,2,0,0,0,0|0,0,0]=2 427 B13R1.1511 CCOC(=O)C1=CC=C(I)C=C1F 0548AB [0,2,0,0,0,0|0,0,0]=2 428 B13R1.1511 CCOC(=O)C1=CC=C(N)C=C1C 6703AH [0,2,0,0,0,0|0,0,0]=2 429 B13R1.1511 CCOC(=O)C1=CN=C(C)N=C1Cl Y3305 [0,2,0,0,0,0|2,0,0]=4 430 B13R1.1511 CCOC(=O)C1=CN=C(C)N=C1O W6761 [0,2,0,0,0,0|2,0,0]=4 431 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1C Y5324 [0,2,0,0,0,0|2,0,0]=4 432 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1N Y7624 [0,2,0,0,0,0|2,0,0]=4 433 B13R1.1511 CCOC(=O)C1=NC=C(Br)C=C1C Z0850 [0,2,0,0,0,0|1,0,0]=3 434 B13R1.1511 CCOC(=O)C1=NC=C(Cl)C=C1Br 3858AA [0,2,0,0,0,0|1,0,0]=3 435 B13R1.1511 CCOC(=O)C1=NN=C(Cl)C=C1Cl W7825 [0,2,0,0,0,0|2,0,0]=4 436 B13R1.1511 CCOC(=O)C1=NN=C(O)C=C1O 6303AA [0,2,0,0,0,0|2,0,0]=4 437 B13R1.1511 O=C(CCCl)C1=C(F)C=C(Br)C=C1 4951AJ [0,2,0,0,0,0|2,0,0]=4 438 B13R1.12 CCNC(=O)C1=C(C)C(N)=CC=C1 3389AF [0,2,0,0,0,0|1,0,0]=3 439 B13R1.12 CCOC(=O)C1=C(C)C(C)=CC=C1 6675AJ [0,2,0,0,0,0|0,0,0]=2 440 B13R1.12 CCOC(=O)C1=CC=CC(Cl)=C1F Z5115 [0,2,0,0,0,0|0,0,0]=2 441 B13R1.12 CCOC(=O)C1=CC=CC(F)=C1C 2373AA [0,2,0,0,0,0|0,0,0]=2 442 B13R1.12 CCOC(=O)C1=CC=CC(N)=C1C Y5475 [0,2,0,0,0,0|0,0,0]=2 443 B13R1.18 O=C(NCCO)C1=CC=CC(Br)=C1 V6733 [0,2,0,0,0,0|1,0,0]=3 444 B13R1.22 CON(C)C(=O)C1=CC=CC(Br)=C1 0629AB [0,2,0,0,0,0|2,0,0]=4 445 B13R1.22 CON(C)C(=O)C1=CC=CC(Cl)=C1 7223AA [0,2,0,0,0,0|2,0,0]=4 446 B13R1.147 CC(C)NC(=O)C1=CC=CC(Br)=C1 V5439 [0,2,0,0,0,0|1,0,0]=3 447 B13R1.147 CC(C)NC(=O)C1=CC=CC(F)=C1 V6039 [0,2,0,0,0,0|1,0,0]=3 448 B13R1.147 CC(C)NC(=O)C1=CC=CC(N)=C1 V7863 [0,2,0,0,0,0|1,0,0]=3 449 B13R1.446 CCOC(=O)C1=C(Cl)N=NC(Cl)=C1 4065AB [0,2,0,0,0,0|2,0,0]=4 450 B13R1.446 CCOC(=O)C1=C(N)C=CC(Br)=C1 3339AL [0,2,0,0,0,0|0,0,0]=2 451 B13R1.446 CCOC(=O)C1=CC(Br)=CN=C1F Y3837 [0,2,0,0,0,0|1,0,0]=3 452 B13R1.446 CCOC(=O)C1=CC(Cl)=NC=C1Br 3850AA [0,2,0,0,0,0|1,0,0]=3 453 B13R1.446 CCOC(=O)C1=CC(Cl)=NC=C1Cl Z0721 [0,2,0,0,0,0|1,0,0]=3 454 B13R1.446 CCOC(=O)C1=CC(Cl)=NN=C1O W7367 [0,2,0,0,0,0|2,0,0]=4 455 B13R1.446 CCOC(=O)C1=NC(Cl)=CC=C1Br Z6896 [0,2,0,0,0,0|1,0,0]=3 456 B13R1.446 CCOC(=O)C1=NC(Cl)=CC=C1C 3147AC [0,2,0,0,0,0|1,0,0]=3 457 B13R1.446 CCOC(=O)C1=NC(Cl)=NC=C1N 8940AB [0,2,0,0,0,0|2,0,0]=4 458 B13R1.446 CCOC(=O)C1=NC(N)=CC=C1Br Z8307 [0,2,0,0,0,0|1,0,0]=3 459 B13R1.450 CCOC(=O)C1=CC(Br)=CC(C)=C1 6732AJ [0,2,0,0,0,0|0,0,0]=2 460 B13R1.450 CCOC(=O)C1=CC(Br)=CC(N)=C1 X5356 [0,2,0,0,0,0|0,0,0]=2 461 B13R1.450 CCOC(=O)C1=CC(Cl)=CC(Br)=C1 X5462 [0,2,0,0,0,0|0,0,0]=2 462 B13R1.450 CCOC(=O)C1=CC(Cl)=NC(C)=C1 5282AB [0,2,0,0,0,0|1,0,0]=3 463 B13R1.450 CCOC(=O)C1=NC(Cl)=CC(C)=C1 X8997 [0,2,0,0,0,0|1,0,0]=3 464 B13R1.450 CCOC(=O)C1=NC(Cl)=CC(Cl)=C1 W8960 [0,2,0,0,0,0|1,0,0]=3 465 B13R1.460 CCOC(=O)C1=CC(C#N)=NC=C1 W7157 [0,2,0,0,0,0|1,0,0]=3 466 B13R1.460 CCOC(=O)C1=CC(CN)=NC=C1 X9343 [0,2,0,0,0,0|1,0,0]=3 467 B13R1.460 CCOC(=O)C1=CC(OC)=NC=C1 Z6813 [0,2,0,0,0,0|1,0,0]=3 468 B13R1.460 CCOC(=O)C1=CC=CC(CBr)=N1 6814AC [0,2,0,0,0,0|1,0,0]=3 469 B13R1.460 CCOC(=O)C1=NC(C#N)=CC=C1 W9825 [0,2,0,0,0,0|1,0,0]=3 470 B13R1.460 CCOC(=O)C1=NC(CCl)=CC=C1 Y9214 [0,2,0,0,0,0|1,0,0]=3 471 B13R1.460 CCOC(=O)C1=NC(CO)=CC=C1 Y9057 [0,2,0,0,0,0|1,0,0]=3 472 B13R1.11 CCC(=O)OC(C)C1=CC=CC=C1 V1502 [0,2,0,0,0,0|1,0,1]=4 473 B13R1.24 CCCCNC(=O)C1=CC=CC=C1 3727AL [0,2,0,0,0,0|1,0,0]=3 474 B13R1.24 CCCCSC(=O)C1=CC=CC=C1 8948AL [0,2,0,0,0,0|0,1,0]=3 475 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 7281AJ [0,2,0,0,0,0|2,0,0]=4 476 B13R1.45 CN(C)\C=N\C(=O)C1=CC=CC=C1 3002AE [0,2,0,0,0,0|1,0,1]=4 477 B13R1.122 NCCCS(=O)(=O)C1=CC=CC=C1 6904AC [0,2,0,0,0,0|2,0,0]=4 478 B13R1.122 O=S(=O)(OCCCl)C1=CC=CC=C1 5572AL [0,2,0,0,0,0|1,0,0]=3 479 B13R1.674 C=CCNC(=O)C1=C(N)C=CC=C1 4253AE [0,2,0,0,0,0|1,0,1]=4 480 B13R1.674 CCCOC(=O)C1=CC=CC=C1O 8944AL [0,2,0,0,0,0|0,0,0]=2 481 B13R1.152 CC(=O)C(C)C(=O)C1=CC=CC=C1 0244AC [0,2,0,0,0,0|1,0,1]=4 482 B13R1.2819 CCNS(=O)(=O)C1=CC=CC=C1N V9913 [0,2,0,0,0,0|2,0,0]=4 483 B13R1.201 CC(C)NC(=O)C1=CC=CC=C1Br V7073 [0,2,0,0,0,0|1,0,0]=3 484 B13R1.201 CC(C)OC(=O)C1=CC=CC=C1N W3948 [0,2,0,0,0,0|0,0,0]=2 485 B13R1.352 C=C(O[Si](C)(C)C)C1=CC=CC=C1 4953AL [0,2,0,0,0,0|1,1,0]=4 486 B13R1.352 CC(C)(C)NC(=O)C1=CC=NC=C1 V7135 [0,2,0,0,0,0|2,0,0]=4 487 B13R1.352 CC(C)(C)NC(=O)C1=CN=CC=C1 V3563 [0,2,0,0,0,0|2,0,0]=4 488 B13R1.352 CS(=O)(=O)CC(=O)C1=CC=CC=C1 1811AE [0,2,0,0,0,0|2,0,0]=4 489 B13R1.464 CCOC(=O)C1=C(C#N)N=CC=C1 W8273 [0,2,0,0,0,0|1,0,0]=3 490 B13R1.464 CCOC(=O)C1=CC=CC=C1C#N Z4997 [0,2,0,0,0,0|0,0,0]=2 491 B13R1.464 CCOC(=O)C1=CC=CC=C1C=O P632 [0,2,0,0,0,0|0,0,0]=2 492 B13R1.4453 CCOC(=O)C1=C(Br)C=NC=C1Br 3879AA [0,2,0,0,0,0|1,0,0]=3 493 B13R1.4453 CCOC(=O)C1=C(C)C=CC=C1C X3789 [0,2,0,0,0,0|0,0,0]=2 494 B13R1.4453 CCOC(=O)C1=C(Cl)N=CC=C1Cl W7410 [0,2,0,0,0,0|1,0,0]=3 495 B13R1.4453 CCOC(=O)C1=C(Cl)N=CN=C1Cl W8991 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.4453 CCOC(=O)C1=C(O)C=CC=C1Cl X9002 [0,2,0,0,0,0|0,0,0]=2 497 B11R2.1 CC1=CCC2=C1C=CC=C2 1962AC [1,0,0,1,0,0|1,0,1]=4 498 B11R2.1 ClC1CCC2=C1C=CC=C2 X6210 [1,0,0,1,0,0|1,0,1]=4 499 B11R2.1 NC1=NCC2=C1C=CC=C2 2334AL [1,0,0,1,0,0|2,0,0]=4 500 B11R2.1 NN1CCC2=C1C=CC=C2 3264AF [1,0,0,1,0,0|2,0,0]=4 501 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 X8642 [1,0,0,1,0,0|1,0,1]=4 502 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 Z4595 [1,0,0,1,0,0|1,0,1]=4 503 B11R2.1 O=C1CCC2=C1C=CN=C2 4302AB [1,0,0,1,0,0|1,0,0]=3 504 B11R2.1 O=C1CCC2=CC=CN=C12 W5328 [1,0,0,1,0,0|1,0,0]=3 505 B11R2.1 O=C1CCC2=NC=CC=C12 W5126 [1,0,0,1,0,0|1,0,0]=3 506 B11R2.1 O=C1CSC2=CC=CC=C12 X9761 [1,0,0,1,0,0|1,0,0]=3 507 B11R2.1 O=C1NCC2=C1C=CC=N2 5330AB [1,0,0,1,0,0|2,0,0]=4 508 B11R2.1 O=C1SSC2=C1C=CC=C2 6202AB [1,0,0,1,0,0|1,1,0]=4 509 B11R2.40 CC1(C2=CC=CC=C2)CO1 5786AL [1,0,0,1,0,0|1,0,1]=4 510 B11R2.40 NC1(C2=CC=CC=C2)CC1 W8184 [1,0,0,1,0,0|1,0,1]=4 511 B11R2.40 NC1(C2=CC=CC=C2)CC1 X2090 [1,0,0,1,0,0|1,0,1]=4 512 B11R2.20 C1=CC2=C(C=C1)CCC=C2 5653AF [1,0,0,1,0,0|1,0,0]=3 513 B11R2.20 C1=CC2=C(C=C1)OCCC2 V6174 [1,0,0,1,0,0|2,0,0]=4 514 B11R2.238 C1=CC=C(NC2CC2)C=C1 Z3373 [1,0,0,1,0,0|2,0,0]=4 515 B11R2.106 O=C1CCCC2=C1C=CO2 8579AA [0,0,0,1,1,0|2,0,0]=4 516 B11R2.106 O=C1NCCN2C=CC=C12 W6903 [0,0,0,1,1,0|2,0,0]=4 517 B11R2.1031 O=C(C1=CC=CS1)C2CC2 Q399 [0,0,0,1,1,0|2,0,0]=4 518 B13R2.15 O=C1NCCN1C2=CC=CC=C2 Y8069 [0,0,0,1,0,1|1,0,0]=3 519 B13R2.26 CCCC1=NC2=CC=CC=C2N1 W6884 [0,0,0,1,0,1|2,0,0]=4 520 B13R2.64 C1=CC=C(CC2OCCO2)C=C1 5508AL [0,0,0,1,0,1|0,0,2]=4 521 B13R2.135 CCN1C(=O)NC2=CC=CC=C21 Z6277 [0,0,0,1,0,1|1,0,0]=3 522 B13R2.135 CCN1C(C)=CC2=C1C=CC=C2 5580AB [0,0,0,1,0,1|2,0,0]=4 523 B13R2.135 CC[N+]1=C(C)OC2=C1C=CC=C2 6041AL [0,0,0,1,0,1|2,0,0]=4 524 B13R2.135 CC[N+]1=C(C)SC2=C1C=CC=C2 6040AL [0,0,0,1,0,1|2,0,0]=4 525 B13R2.328 CN1CC(=O)NC2=CC=CC=C21 0305AC [0,0,0,1,0,1|2,0,0]=4 526 B13R2.3 C1=CC=C(B2OCCCO2)C=C1 X0801 [0,1,0,1,0,0|1,0,1]=4 527 B13R2.3 C1=CC=C([C@@H]2CNCCO2)C=C1 4288AA [0,1,0,1,0,0|1,0,1]=4 528 B13R2.10 CC1=NOC(C2=CC=CC=C2)=C1 Z2742 [0,1,0,1,0,0|1,0,1]=4 529 B13R2.10 CC1=NOC(C2=CC=CC=C2)=N1 3449AA [0,1,0,1,0,0|1,0,1]=4 530 B13R2.2931 CN1N=C(C=O)C2=C1C=CC=C2 Y5422 [0,1,0,1,0,0|2,0,0]=4 531 B13R2.2931 COC1OC(=O)C2=C1C=CC=C2 W6167 [0,1,0,1,0,0|0,0,0]=2 532 B13R2.12 BrC1=CC=C(C2OCCO2)C=C1 Z2389 [0,1,0,1,0,0|0,0,2]=4 533 B13R2.520 O=C(C1=CC=C(O)C=C1)C2CC2 3233AL [0,1,0,1,0,0|1,0,0]=3 534 B13R2.5179 O=C1CCCC2=C1C=CC(Cl)=C2 X4964 [0,1,0,1,0,0|1,0,0]=3 535 B13R2.5179 O=C1CCCC2=C1C=CC(I)=C2 3557AJ [0,1,0,1,0,0|1,0,0]=3 536 B13R2.5179 O=C1CCOC2=C1C=CC(Br)=C2 W3989 [0,1,0,1,0,0|2,0,0]=4 537 B13R2.5179 O=C1CCOC2=C1C=CC(Cl)=C2 W3985 [0,1,0,1,0,0|2,0,0]=4 538 B13R2.5179 O=C1CCOC2=C1C=CC(F)=C2 X9046 [0,1,0,1,0,0|2,0,0]=4 539 B13R2.5179 O=C1CCOC2=C1C=CC(O)=C2 Z5109 [0,1,0,1,0,0|2,0,0]=4 540 B13R2.5179 O=C1NCCC2=C1C=CC(Br)=C2 W3213 [0,1,0,1,0,0|1,0,0]=3 541 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 0878AB [0,1,0,1,0,0|1,0,0]=3 542 B13R2.5179 O=C1NCCC2=C1C=CC(O)=C2 W4585 [0,1,0,1,0,0|1,0,0]=3 543 B13R2.5187 O=C1OC(=O)C2=C1C=CC(O)=C2 V2120 [0,1,0,1,0,0|1,0,1]=4 544 B13R2.13 NC1=CC(C2OCCO2)=CC=C1 7247AE [0,1,0,1,0,0|0,0,2]=4 545 B13R2.162 CC1=CC2=C(C=C1)CCCC2=O 6492AJ [0,1,0,1,0,0|1,0,0]=3 546 B13R2.162 CC1=CC2=C(C=C1)OCCC2=O 5174AB [0,1,0,1,0,0|2,0,0]=4 547 B13R2.162 NC1=CC2=C(C=C1)CCCC2=O W4538 [0,1,0,1,0,0|1,0,0]=3 548 B13R2.162 NC1=CC2=C(C=C1)CCNC2=O Z5008 [0,1,0,1,0,0|1,0,0]=3 549 B13R2.162 O=C1CCNC2=CC=C(Cl)C=C12 0995AB [0,1,0,1,0,0|2,0,0]=4 550 B13R2.162 O=C1CCOC2=C1C=C(Br)C=C2 W6518 [0,1,0,1,0,0|2,0,0]=4 551 B13R2.162 O=C1CCOC2=C1C=C(Br)C=C2 X3934 [0,1,0,1,0,0|2,0,0]=4 552 B13R2.162 O=C1CCOC2=C1C=C(I)C=C2 0444AA [0,1,0,1,0,0|2,0,0]=4 553 B13R2.162 O=C1CCSC2=C1C=C(Cl)C=C2 3020AL [0,1,0,1,0,0|2,0,0]=4 554 B13R2.162 O=C1CCSC2=CC=C(Br)C=C12 8261AJ [0,1,0,1,0,0|2,0,0]=4 555 B13R2.162 O=C1NCCC2=C1C=C(Br)C=C2 W9209 [0,1,0,1,0,0|1,0,0]=3 556 B13R2.162 O=C1NCCC2=C1C=C(Cl)C=C2 3696AJ [0,1,0,1,0,0|1,0,0]=3 557 B13R2.162 O=C1NCCC2=C1C=C(O)C=C2 1260AB [0,1,0,1,0,0|1,0,0]=3 558 B13R2.342 CC1=C2OCCC(=O)C2=CC=C1 6729AB [0,1,0,1,0,0|2,0,0]=4 559 B13R2.342 O=C1CCCC2=C(Cl)C=CC=C12 X3528 [0,1,0,1,0,0|1,0,0]=3 560 B13R2.342 O=C1CCCC2=C(F)C=CC=C12 5942AC [0,1,0,1,0,0|1,0,0]=3 561 B13R2.342 O=C1CCCC2=C1C=CC=C2Br W7858 [0,1,0,1,0,0|1,0,0]=3 562 B13R2.342 O=C1CCNC2=C1C=CC=C2Br 0946AQ [0,1,0,1,0,0|2,0,0]=4 563 B13R2.342 O=C1CCOC2=C1C=CC=C2F 2040AA [0,1,0,1,0,0|2,0,0]=4 564 B13R2.342 O=C1NCCC2=C1C=CC=C2F 1476AB [0,1,0,1,0,0|1,0,0]=3 565 B13R2.342 O=C1NCCC2=C1C=CC=C2O 8253AB [0,1,0,1,0,0|1,0,0]=3 566 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2Br X7115 [0,1,0,1,0,0|1,0,1]=4 567 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2I X7116 [0,1,0,1,0,0|1,0,1]=4 568 B13R2.371 CC1=NNC(=O)C2=C1C=CC=C2 6799AB [0,1,0,1,0,0|1,0,1]=4 569 B13R2.371 O=C1CNC(=O)C2=CC=CC=C12 1346AJ [0,1,0,1,0,0|1,0,1]=4 570 B13R2.5252 O=C1CCCOC2=CC=CC=C12 Y3225 [0,1,0,1,0,0|1,0,0]=3 571 B13R2.8137 O=C(C1=CC=CC=C1)C2CCC2 5254AE [0,1,0,1,0,0|1,0,0]=3 572 B13R2.32 O=C1C2=C(C=CC=C2)CCC1Br 6502AA [0,1,0,1,0,0|1,0,0]=3 573 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 6972AD [0,1,0,1,0,0|2,0,0]=4 574 B13R2.12159 CC1(C)O[IH2](F)C2=C1C=CC=C2 4860AL [0,1,0,1,0,0|2,0,0]=4 575 B13R2.12159 O=C1OS(=O)(=O)C2=CC=CC=C12 U162 [0,1,0,1,0,0|2,0,0]=4 576 B13R2.4818 O=C1CCCC2=C1C(Br)=CC=C2 6057AH [0,1,0,1,0,0|1,0,0]=3 577 B13R2.4818 O=C1CCCC2=C1C(Cl)=CC=C2 X6345 [0,1,0,1,0,0|1,0,0]=3 578 B9R1.11 CCC(=O)C1=CC=CN1 2175AL [1,0,0,0,1,0|1,0,0]=3 579 B9R1.11 COC(=O)C1=CC=NO1 W3292 [1,0,0,0,1,0|2,0,0]=4 580 B9R1.11 COC(=O)C1=CN=CN1 5358AA [1,0,0,0,1,0|2,0,0]=4 581 B9R1.11 COC(=O)C1=CN=CO1 Y7252 [1,0,0,0,1,0|2,0,0]=4 582 B9R1.11 COC(=O)C1=COC=N1 8746AA [1,0,0,0,1,0|2,0,0]=4 583 B9R1.11 COC(=O)C1=CSC=N1 Y5483 [1,0,0,0,1,0|2,0,0]=4 584 B9R1.11 COC(=O)C1=NC=CN1 W3783 [1,0,0,0,1,0|2,0,0]=4 585 B9R1.11 COC(=O)N1C=CC=C1 3202AE [1,0,0,0,1,0|1,0,0]=3 586 B9R1.11 CSC(=O)C1=CC=CO1 9771AJ [1,0,0,0,1,0|1,1,0]=4 587 B9R1.11 O=C(CBr)C1=CC=CN1 Z2515 [1,0,0,0,1,0|2,0,0]=4 588 B9R1.11 O=C(CBr)C1=CC=CS1 Y6915 [1,0,0,0,1,0|2,0,0]=4 589 B9R1.12 CCOCC1=CC=CO1 Z4965 [1,0,0,0,1,0|1,0,1]=4 590 B13R1.42 CCOC(=O)CCC1=CC=CC=N1 2599AB [0,0,0,0,0,2|1,0,0]=3 591 B13R1.42 CCOC(=O)CCC1=CN=CC=C1 6709AJ [0,0,0,0,0,2|1,0,0]=3 592 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 0809AP [0,0,0,0,0,2|0,0,0]=2 593 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 1847AB [0,0,0,0,0,2|1,0,0]=3 594 B13R1.42 CCOC(=O)\C=C\C1=CN=CC=C1 2787AB [0,0,0,0,0,2|1,0,0]=3 595 B13R1.42 CNCC(=O)OCC1=CC=CC=C1 7563AH [0,0,0,0,0,2|2,0,0]=4