0 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 SY067507 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 SY101325 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.3 C#CC1=CN=C(N(C)C)C=C1 SY060588 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SY204715 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.3 C=CC1=CC=C(B(O)O)C=C1 SY023516 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 SY011290 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.3 C=CC1=CC=C(N(C)C)C=C1 SY019506 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.3 C=CC1=CC=C([N+](=O)[O-])C=C1 SY059044 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SY012989 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 SY039033 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.3 CC(C)C1=CC=C(NN)C=C1 SY011417 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.3 CC(C)C1=CC=C(ON)C=C1 SY282101 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.3 CC(C)C1=CC=C(ON)C=C1 SY282102 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SY049093 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.3 CN(C)C1=CC=C(C#N)C=C1 SY011434 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.3 CN(C)C1=CC=C(CN)C=C1 SY002797 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.3 CN(C)C1=CC=[N+](C#N)C=C1 SY058029 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.3 COC1=CC=C(C(C)N)C=C1 SY003775 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.3 COC1=CC=C(C(C)N)C=C1 SY005337 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.3 COC1=CC=C(C(F)F)C=C1 SY265653 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 SY020344 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 SY114791 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 SY030476 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 SY194794 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.3 C[C@@H](N)C1=CC=C(CO)C=C1 SY259141 [0,0,0,0,0,0|1,0,2]=3 25 B11R1.3 C[C@@H](O)C1=CC=C(C#N)C=C1 SY269304 [0,0,0,0,0,0|2,0,1]=3 26 B11R1.3 N#CC1=CC=C(C(F)F)C=C1 SY041836 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SY001684 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 SY001417 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.3 O=CC1=NC=C([N+](=O)[O-])C=C1 SY042410 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.3 C#CC1=CC=C(CBr)C=C1 SY253572 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.3 C#CC1=CC=C(CC)C=C1 SY018461 [1,0,0,0,0,0|1,0,1]=3 32 B10R1.3 C#CC1=CC=C(OC)C=C1 SY013463 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.3 C(=O)C1=CC=C(C#C)C=C1 SY008404 [1,0,0,0,0,0|0,0,2]=3 34 B10R1.3 C=CC1=CC=C(OC)C=C1 SY012921 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.3 C=CC1=CC=C(ON)C=C1 SY282282 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.3 C=CC1=CC=C(ON)C=C1 SY282283 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.3 CCC1=CC=C(C#N)C=C1 SY027537 [1,0,0,0,0,0|1,0,1]=3 38 B10R1.3 CCC1=CC=C(NN)C=C1 SY014211 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.3 CCC1=CC=C(OC)C=C1 SY048267 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.3 CCC1=CC=C(ON)C=C1 SY282112 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.3 CCC1=CC=C(ON)C=C1 SY282113 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.3 CNC1=CC=C(C#N)C=C1 SY018924 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.3 CNC1=CC=C(OC)C=C1 SY050557 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.3 COC1=CC=C(C=O)C=N1 SY014910 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.3 COC1=CC=C(ON)C=C1 SY251453 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.3 COC1=CC=C(ON)C=C1 SY282040 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.3 COC1=CN=C(C=O)C=C1 SY039034 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.3 COC1=NC=C(C=O)C=N1 SY022439 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.3 CSC1=CC=C(ON)C=C1 SY282336 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.3 CSC1=CC=C(ON)C=C1 SY282337 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.3 N#CC1=CC=C(CN)C=C1 SY007868 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.3 N#CC1=CC=C(CO)C=C1 SY025114 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.3 NCC1=CC=C(CO)C=C1 SY025012 [1,0,0,0,0,0|1,0,2]=4 54 B10R1.3 NCC1=CC=C(CO)C=C1 SY025721 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.3 O=CC1=CC=C(CBr)C=C1 SY023703 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.3 O=CC1=CC=C(CCl)C=C1 SY109144 [1,0,0,0,0,0|1,0,0]=2 57 B10R1.3 O=CC1=CC=C(CO)C=C1 SY023702 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.3 O=CC1=NC=C(CO)C=C1 SY225996 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.3 OCC1=CC=C(CBr)C=C1 SY110926 [1,0,0,0,0,0|1,0,2]=4 60 B10R1.3 OCC1=CC=C(CO)C=C1 SY036781 [1,0,0,0,0,0|1,0,2]=4 61 B10R1.13 C1=CC(Cl)=CC=C1N(C)C SY246299 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 C1=CC(F)=CC=C1N(C)C SY246298 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 C=C(C)C1=CC=C(Br)C=C1 SY225322 [1,0,0,0,0,0|1,0,2]=4 64 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 SY048599 [1,0,0,0,0,0|1,0,2]=4 65 B10R1.13 C=C(C)C1=CC=C(F)C=C1 SY048549 [1,0,0,0,0,0|1,0,2]=4 66 B10R1.13 C=C(C)C1=CC=C(I)C=C1 SY225345 [1,0,0,0,0,0|1,0,2]=4 67 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SY001458 [1,0,0,0,0,0|2,0,1]=4 68 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SY011859 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SY011145 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SY009665 [1,0,0,0,0,0|1,0,2]=4 71 B10R1.13 CC(C)C1=CC=C(Br)C=C1 SY002711 [1,0,0,0,0,0|1,0,0]=2 72 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 SY029740 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.13 CC(N)C1=CC=C(Br)C=C1 SY020147 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.13 CC(N)C1=CC=C(F)C=C1 SY002633 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.13 CC(N)C1=CC=C(F)N=C1 SY249602 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.13 CC(N)C1=NC=C(Br)C=C1 SY046404 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.13 CC(O)C1=CC=C(Br)C=C1 SY005047 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SY005059 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.13 CC(O)C1=CC=C(F)C=C1 SY005049 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.13 CC1=CC=C(C(C)N)C=C1 SY002631 [1,0,0,0,0,0|1,0,1]=3 81 B10R1.13 CC1=CC=C(C(C)O)C=C1 SY005050 [1,0,0,0,0,0|1,0,1]=3 82 B10R1.13 CC1=CC=C(C(F)F)C=C1 SY265627 [1,0,0,0,0,0|2,0,1]=4 83 B10R1.13 CN(C)C1=CC=C(Br)C=C1 SY013736 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 SY027100 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.13 CN(C)C1=NC=C(Br)C=C1 SY024322 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.13 CN(C)C1=NC=C(I)C=C1 SY096673 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 SY253160 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 SY009358 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 SY031357 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 SY007454 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 SY024772 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 SY116631 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SY009324 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 SY009349 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 SY007451 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SY024771 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 SY009323 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.13 Cc1ccc(C(C)C)cc1 SY010591 [1,0,0,0,0,0|0,0,1]=2 99 B10R1.13 Cc1ccc(C(C)C)cc1 SY010592 [1,0,0,0,0,0|0,0,1]=2 100 B10R1.13 FC(F)C1=CC=C(Br)C=C1 SY041190 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 SY036853 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.13 NC1=CC=C(C(F)F)C=C1 SY265648 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 SY104735 [0,1,0,0,0,0|2,0,1]=4 104 B12R1.5 CC(CN)C1=CC=C(C#N)C=C1 SY275840 [0,1,0,0,0,0|1,0,1]=3 105 B12R1.5 CNC(=O)C1=CC=C(C=O)C=C1 SY128194 [0,1,0,0,0,0|1,0,1]=3 106 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 SY003456 [0,1,0,0,0,0|1,0,1]=3 107 B12R1.5 COC(=O)C1=CN=C(C=O)C=C1 SY064962 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.5 COC(=O)C1=NC=C(C=O)C=C1 SY038159 [0,1,0,0,0,0|2,0,1]=4 109 B12R1.5 CSC1=CC=C(C(N)CO)C=C1 SY278514 [0,1,0,0,0,0|3,0,0]=4 110 B12R1.6 C#CC1=CC=C(C(C)(C)C)C=C1 SY061552 [0,1,0,0,0,0|1,0,1]=3 111 B12R1.6 C=CC1=CC=C(C(F)(F)F)C=C1 SY025100 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.6 C=CC1=CC=C([Sn](C)(C)C)C=C1 SY247517 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.6 CC(C)(C)C1=CC=C(CN)C=C1 SY030278 [0,1,0,0,0,0|1,0,1]=3 114 B12R1.6 CC(C)(C)C1=CC=C(ON)C=C1 SY282025 [0,1,0,0,0,0|2,0,0]=3 115 B12R1.6 CC(C)(C)C1=CC=C(ON)C=C1 SY282026 [0,1,0,0,0,0|2,0,0]=3 116 B12R1.6 CC(C)(N)C1=CC=C(C#N)C=C1 SY038352 [0,1,0,0,0,0|1,0,1]=3 117 B12R1.6 CS(=O)(=O)C1=CC=C(C=O)C=C1 SY002002 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.6 NS(=O)(=O)C1=CC=C(C=O)C=C1 SY082574 [0,1,0,0,0,0|3,0,0]=4 119 B12R1.6 O=CC1=CC=C(C(F)(F)F)N=C1 SY002806 [0,1,0,0,0,0|3,0,0]=4 120 B12R1.6 O=CC1=CC=C(S(=O)(=O)Cl)C=C1 SY045709 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.6 O=CC1=CC=C(S(=O)(=O)O)C=C1 SY128545 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.6 O=CC1=NC=C(C(F)(F)F)C=C1 SY040938 [0,1,0,0,0,0|3,0,0]=4 123 B12R1.48 CC(C)C1=CC=C(C=O)C(O)=C1 SY027240 [0,1,0,0,0,0|0,0,0]=1 124 B12R1.48 CC1=CC([N+](=O)[O-])=CC=C1C=O SY025977 [0,1,0,0,0,0|3,0,0]=4 125 B12R1.48 CN(C)C1=CC=C(C=O)C(O)=C1 SY029359 [0,1,0,0,0,0|1,0,0]=2 126 B12R1.48 O=CC1=CC=C(B(O)O)C=C1F SY025272 [0,1,0,0,0,0|3,0,0]=4 127 B12R1.48 O=CC1=CC=C(C(=O)O)C=C1Br SY108753 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.48 O=CC1=CC=C([N+](=O)[O-])C=C1Br SY025068 [0,1,0,0,0,0|3,0,0]=4 129 B12R1.48 O=CC1=CC=C([N+](=O)[O-])C=C1F SY031419 [0,1,0,0,0,0|3,0,0]=4 130 B12R1.48 O=CC1=CC=C([N+](=O)[O-])C=C1O SY031966 [0,1,0,0,0,0|3,0,0]=4 131 B12R1.113 CC(C)C1=CC=C(OCCl)C=C1 SY298429 [0,1,0,0,0,0|1,0,1]=3 132 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 SY023365 [0,1,0,0,0,0|2,0,1]=4 133 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 SY014779 [0,1,0,0,0,0|3,0,0]=4 134 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 SY012789 [0,1,0,0,0,0|1,0,1]=3 135 B12R1.256 CC(=O)C1=CC=C(N(C)C)C=C1 SY009082 [0,1,0,0,0,0|1,0,0]=2 136 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 SY011156 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.256 CC(C)C1=CC=C(B(O)O)C=C1 SY007874 [0,1,0,0,0,0|1,0,1]=3 138 B12R1.256 CC(C)C1=CC=C(C(F)F)C=C1 SY265632 [0,1,0,0,0,0|1,0,1]=3 139 B12R1.256 CC(O)C1=CC=C(B(O)O)C=C1 SY103371 [0,1,0,0,0,0|2,0,1]=4 140 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 SY020954 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 SY116044 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 SY020179 [0,1,0,0,0,0|1,0,0]=2 143 B12R1.256 CN(C)C1=CC=C(C(F)F)C=C1 SY265631 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.256 CN(C)C1=CC=C(N(C)C)C=C1 SY061584 [0,1,0,0,0,0|3,0,0]=4 145 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 SY240401 [0,1,0,0,0,0|1,0,0]=2 146 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 SY041345 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.256 C[SiH](C)C1=CC=C([SiH](C)C)C=C1 SY041884 [0,1,0,0,0,0|1,2,0]=4 148 B12R1.256 NC(=O)C1=CC=C(B(O)O)C=C1 SY024633 [0,1,0,0,0,0|3,0,0]=4 149 B12R1.256 NC(=O)C1=CC=C(C(=O)O)C=C1 SY050472 [0,1,0,0,0,0|2,0,1]=4 150 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 SY001195 [0,1,0,0,0,0|3,0,0]=4 151 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 SY002161 [0,1,0,0,0,0|3,0,0]=4 152 B12R1.452 O=CC1=CC=C(B(O)O)C(Cl)=C1 SY104656 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.452 O=CC1=CC=C(B(O)O)C(F)=C1 SY027920 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.452 O=CC1=CC=C(C(=O)O)C(Cl)=C1 SY274506 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.452 O=CC1=CC=C([N+](=O)[O-])C(Br)=C1 SY065954 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.452 O=CC1=CC=C([N+](=O)[O-])C(F)=C1 SY037237 [0,1,0,0,0,0|3,0,0]=4 157 B12R1.452 O=CC1=CC=C([N+](=O)[O-])C(O)=C1 SY021498 [0,1,0,0,0,0|3,0,0]=4 158 B12R2.9 C=CC1=CC=C(C2CO2)C=C1 SY286660 [0,0,0,1,0,0|2,0,0]=3 159 B12R2.9 CCC1=CC=C(C2CC2)C=C1 SY263938 [0,0,0,1,0,0|1,0,1]=3 160 B12R2.9 CNC1=CC=C(C2CC2)C=C1 SY264169 [0,0,0,1,0,0|2,0,0]=3 161 B12R2.9 COC1=CC=C(C2CC2)C=C1 SY263826 [0,0,0,1,0,0|2,0,0]=3 162 B12R2.9 N#CC1=CC=C(C2CC2)C=C1 SY065821 [0,0,0,1,0,0|1,0,1]=3 163 B12R2.9 N#CC1=CC=C(C2CC2)N=C1 SY238208 [0,0,0,1,0,0|2,0,1]=4 164 B12R2.9 NCC1=CC=C(C2CC2)N=C1 SY236882 [0,0,0,1,0,0|2,0,1]=4 165 B12R2.9 OCC1=CC=C(C2CC2)C=C1 SY249667 [0,0,0,1,0,0|0,0,2]=3 166 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 SY036403 [0,0,0,0,0,1|2,0,1]=4 167 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 SY011377 [0,0,0,0,0,1|1,0,1]=3 168 B12R1.4 CC(=O)OC1=CC=C(C=O)C=C1 SY042565 [0,0,0,0,0,1|1,0,1]=3 169 B12R1.4 CC(C)OC1=NC=C(C=O)C=C1 SY022280 [0,0,0,0,0,1|1,0,0]=2 170 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 SY152150 [0,0,0,0,0,1|2,0,1]=4 171 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 SY026371 [0,0,0,0,0,1|2,0,1]=4 172 B12R1.4 O=CC1=CC=C(OC(F)F)C=C1 SY017706 [0,0,0,0,0,1|2,0,0]=3 173 B9R1.1 C(=O)C1=CC=C(N)C=C1 SY003470 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.1 C(=O)C1=NC=C(C)C=C1 SY022267 [2,0,0,0,0,0|1,0,0]=3 175 B9R1.1 C=CC1=CC=C(Br)C=C1 SY017044 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.1 C=CC1=CC=C(N)C=C1 SY010310 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.1 CC1=CC=C(ON)C=C1 SY282046 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.1 CC1=CC=C(ON)C=C1 SY282047 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.1 CC1=NC=C(C=O)C=C1 SY028284 [2,0,0,0,0,0|1,0,0]=3 180 B9R1.1 CC1=NC=C(C=O)C=N1 SY020293 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.1 CCC1=CC=C(C)C=C1 SY035727 [2,0,0,0,0,0|0,0,1]=3 182 B9R1.1 CCC1=CC=C(I)C=C1 SY101013 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.1 CCC1=CC=C(N)C=C1 SY012867 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.1 CCC1=CN=C(N)C=C1 SY025370 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.1 CCC1=NC=C(Br)C=C1 SY096806 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.1 CCC1=NNC(=O)C=C1 SY060323 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.1 CNC1=CC=C(Br)C=C1 SY050556 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.1 COC1=CC=C(Cl)C=C1 SY005701 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.1 COC1=CC=C(I)C=C1 SY001036 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.1 NC1=CC=C(CO)C=C1 SY015076 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.1 NC1=NC=C(C=O)C=C1 SY035532 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.1 NCC1=CC=C(I)C=C1 SY050233 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.1 NCC1=CC=C(N)C=C1 SY058286 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.1 NCC1=CC=C(O)C=C1 SY026754 [2,0,0,0,0,0|1,0,1]=4 195 B9R1.1 O=CC1=CC=C(Br)C=C1 SY001094 [2,0,0,0,0,0|1,0,0]=3 196 B9R1.1 O=CC1=CC=C(Cl)N=C1 SY017266 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.1 O=CC1=CC=C(I)C=C1 SY025388 [2,0,0,0,0,0|1,0,0]=3 198 B9R1.1 O=CC1=CC=C(O)C=C1 SY003489 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.1 O=CC1=CN=C(Br)C=C1 SY002969 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.1 O=CC1=CN=C(F)C=C1 SY022307 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.1 O=CC1=CN=C(O)C=C1 SY018144 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.1 O=CC1=NC=C(Br)C=C1 SY002971 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.1 O=CC1=NC=C(Cl)C=C1 SY022271 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.1 O=CC1=NC=C(F)C=C1 SY015686 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.1 O=CC1=NC=C(O)C=C1 SY043065 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.1 OCC1=CC=C(Br)C=C1 SY006440 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.1 OCC1=CC=C(Cl)C=C1 SY001234 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.1 OCC1=CC=C(F)C=C1 SY006438 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.1 OCC1=CC=C(I)C=C1 SY019171 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.1 OCC1=CC=C(O)C=C1 SY003753 [2,0,0,0,0,0|1,0,1]=4 211 B9R1.6 CC(C)C1=CC=CCC1 SY292102 [2,0,0,0,0,0|0,0,2]=4 212 B9R1.6 CC(C)C1=CCCC=C1 SY292103 [2,0,0,0,0,0|0,0,2]=4 213 B9R1.6 CC(N)C1=CC=CN=C1 SY005518 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.6 CC(N)C1=CC=NC=C1 SY005514 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.6 CC(N)C1=NC=CC=C1 SY005425 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.6 CC(N)C1=NC=CC=C1 SY023696 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.6 CC(O)C1=CC=CN=C1 SY006085 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.6 CC(O)C1=CC=NC=C1 SY006084 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.6 CC(O)C1=NC=CC=C1 SY004070 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.6 C[C@@H](N)C1=CC=CN=C1 SY105422 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.6 C[C@@H](N)C1=CC=NC=C1 SY011547 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.6 C[C@@H](N)C1=CC=NC=C1 SY253760 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.6 C[C@@H](N)C1=NC=CC=C1 SY016895 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.6 C[C@@H](O)C1=CC=CC=C1 SY007833 [2,0,0,0,0,0|1,0,0]=3 225 B9R1.6 C[C@@H](O)C1=CN=CC=C1 SY008212 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.6 C[C@@H](O)C1=NC=CC=C1 SY009224 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.6 C[C@H](N)C1=CC=CN=C1 SY033903 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.6 C[C@H](N)C1=CC=NC=C1 SY011546 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.6 C[C@H](N)C1=NC=CC=C1 SY010698 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.6 C[C@H](O)C1=CN=CC=C1 SY008211 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.6 FC(F)C1=CC=CC=C1 SY024386 [2,0,0,0,0,0|2,0,0]=4 232 B11R1.83 C#CC1=CC=C(CCC)C=C1 SY018919 [1,1,0,0,0,0|1,0,1]=4 233 B11R1.83 C#CC1=CC=C(CNC)C=C1 SY275524 [1,1,0,0,0,0|1,0,1]=4 234 B11R1.83 C#CC1=CC=C(OCC)C=C1 SY020512 [1,1,0,0,0,0|1,0,1]=4 235 B11R1.83 C=CC1=CC=C(CCCl)C=C1 SY165352 [1,1,0,0,0,0|1,0,0]=3 236 B11R1.83 C=CC1=CC=C(CCO)C=C1 SY247572 [1,1,0,0,0,0|1,0,0]=3 237 B11R1.83 C=CC1=CC=C(OCC)C=C1 SY254103 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.83 CCC1=CC=C(CNC)C=C1 SY002785 [1,1,0,0,0,0|1,0,1]=4 239 B11R1.83 CCC1=CC=C(OCCl)C=C1 SY298449 [1,1,0,0,0,0|1,0,1]=4 240 B11R1.83 CCOC1=CC=C(C#N)C=C1 SY048923 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.83 CCOC1=CC=C(C=O)C=C1 SY009945 [1,1,0,0,0,0|0,0,0]=2 242 B11R1.83 CCOC1=CC=C(ON)C=C1 SY282224 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.83 CCOC1=CC=C(ON)C=C1 SY282225 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.83 CCOC1=NC=C(C=O)C=C1 SY066959 [1,1,0,0,0,0|1,0,0]=3 245 B11R1.83 CNCC1=CC=C(OC)C=C1 SY002628 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.83 CNCC1=CC=C(OC)C=C1 SY002786 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.83 COC1=CC=C(CC=O)C=C1 SY025623 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.83 COC1=CC=C(CCO)C=C1 SY014083 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.83 COC1=CC=C(N=C=O)C=C1 SY012590 [1,1,0,0,0,0|1,0,1]=4 250 B11R1.83 COC1=CC=C(\C=C\Br)C=C1 SY268197 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.83 COCC1=CC=C(OC)C=C1 SY022059 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 SY019737 [1,1,0,0,0,0|2,0,0]=4 253 B11R1.83 N#CC1=CC=C(CCO)C=C1 SY100982 [1,1,0,0,0,0|1,0,1]=4 254 B11R1.83 O=CC1=CC=C(CCBr)C=C1 SY250868 [1,1,0,0,0,0|0,0,0]=2 255 B11R1.279 CCC1=CC=C(C=O)C(O)=C1 SY026477 [1,1,0,0,0,0|0,0,0]=2 256 B11R1.279 COC1=CC(I)=C(C=O)C=N1 SY258318 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.279 COC1=CC(O)=C(C=O)C=C1 SY012932 [1,1,0,0,0,0|1,0,0]=3 258 B11R1.279 COC1=CC=C(C=O)C(Br)=C1 SY026349 [1,1,0,0,0,0|1,0,0]=3 259 B11R1.279 COC1=CC=C(C=O)C(C)=C1 SY017673 [1,1,0,0,0,0|1,0,0]=3 260 B11R1.279 COC1=CC=C(C=O)C(Cl)=C1 SY030189 [1,1,0,0,0,0|1,0,0]=3 261 B11R1.279 COC1=CC=C(C=O)C(F)=C1 SY024311 [1,1,0,0,0,0|1,0,0]=3 262 B11R1.279 COC1=CC=C(C=O)C=C1Br SY015500 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.279 COC1=CC=C(C=O)C=C1C SY020960 [1,1,0,0,0,0|1,0,0]=3 264 B11R1.279 COC1=CC=C(C=O)C=C1Cl SY004242 [1,1,0,0,0,0|1,0,0]=3 265 B11R1.279 COC1=CC=C(C=O)C=C1F SY004508 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.279 COC1=CC=C(C=O)C=C1O SY001500 [1,1,0,0,0,0|1,0,0]=3 267 B11R1.279 COC1=NC=C(C=O)C(C)=C1 SY111335 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.279 N#CC1=CC=C(C=O)C(Br)=C1 SY105076 [1,1,0,0,0,0|1,0,1]=4 269 B11R1.279 N#CC1=CC=C(C=O)C(F)=C1 SY041967 [1,1,0,0,0,0|1,0,1]=4 270 B11R1.279 N#CC1=CC=C(C=O)C(O)=C1 SY025920 [1,1,0,0,0,0|1,0,1]=4 271 B11R1.279 N#CC1=CC=C(C=O)C=C1Br SY032516 [1,1,0,0,0,0|1,0,1]=4 272 B11R1.279 N#CC1=CC=C(C=O)C=C1F SY026547 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.19 CC(C)(Br)C1=CC=C(Br)C=C1 SY251002 [1,1,0,0,0,0|1,0,0]=3 274 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 SY010478 [1,1,0,0,0,0|1,0,0]=3 275 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 SY019191 [1,1,0,0,0,0|1,0,0]=3 276 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 SY004366 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.19 CC(C)(C)C1=NC=C(Br)C=C1 SY128727 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.19 CC(C)(F)C1=CN=C(Br)C=C1 SY128733 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.19 CC(C)(F)C1=NC=C(Br)C=C1 SY128735 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 SY038775 [1,1,0,0,0,0|1,0,0]=3 281 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 SY185215 [1,1,0,0,0,0|1,0,0]=3 282 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 SY036029 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.19 CC(C)(O)C1=CC=C(Br)N=C1 SY096815 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.19 CC(C)(O)C1=CC=C(Cl)N=C1 SY146794 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 SY252867 [1,1,0,0,0,0|2,0,0]=4 286 B11R1.19 CC(C)(O)C1=CC=C(O)C=C1 SY272686 [1,1,0,0,0,0|0,0,1]=3 287 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 SY037447 [1,1,0,0,0,0|2,0,0]=4 288 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 SY035975 [1,1,0,0,0,0|2,0,0]=4 289 B11R1.19 C[Si](C)(C)C1=CC=C(Br)C=C1 SY045941 [1,1,0,0,0,0|1,1,0]=4 290 B11R1.19 C[Si](C)(C)C1=CC=C(Cl)C=C1 SY248710 [1,1,0,0,0,0|1,1,0]=4 291 B11R1.21 CC(C)C1=CC(Br)=C(N)C=C1 SY017092 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.21 CC(O)C1=CC=C(Cl)C(Cl)=C1 SY005064 [1,1,0,0,0,0|2,0,0]=4 293 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 SY005066 [1,1,0,0,0,0|2,0,0]=4 294 B11R1.21 CC(O)C1=CC=C(F)C(F)=C1 SY005063 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.21 CN(C)C1=CC=C(Br)C(I)=C1 SY288330 [1,1,0,0,0,0|2,0,0]=4 296 B11R1.21 CN(C)C1=CC=C(Br)C(N)=C1 SY288675 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.21 CN(C)C1=CC=C(I)C(Br)=C1 SY288331 [1,1,0,0,0,0|2,0,0]=4 298 B11R1.22 NC(CO)C1=CC=C(F)C=C1 SY047985 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.22 NCC(O)C1=CC=C(O)C=C1 SY039785 [1,1,0,0,0,0|1,0,1]=4 300 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 SY121979 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 SY111431 [1,1,0,0,0,0|2,0,0]=4 302 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 SY212721 [1,1,0,0,0,0|2,0,0]=4 303 B11R1.166 CC(C)C1=C(Br)C=C(N)C=N1 SY289046 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.166 CC(C)C1=CC=C(N)C=C1O SY260312 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.166 CC(C)C1=CC=C(O)C=C1O SY059257 [1,1,0,0,0,0|0,0,1]=3 306 B11R1.166 CC(C)N1C=CC(Br)=CC1=O SY116068 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.166 CC(O)C1=C(Cl)C=C(Cl)C=C1 SY005062 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.166 CC1=CC(O)=CC=C1C(C)C SY051849 [1,1,0,0,0,0|0,0,1]=3 309 B11R1.166 C[C@@H](N)C1=CC=C(F)C=C1F SY008887 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.50 CC(C)N1N=C(C=O)C=C1I SY281525 [0,1,0,0,1,0|2,0,0]=4 311 B11R1.175 CC(C)C1=CC(C(=O)O)=NN1 SY027523 [0,1,0,0,1,0|2,0,0]=4 312 B11R1.175 CC(C)C1=NC(C(=O)O)=CO1 SY058470 [0,1,0,0,1,0|2,0,0]=4 313 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 SY079030 [0,1,0,0,1,0|2,0,0]=4 314 B11R1.175 CC(C)N1C=NC(C(=O)O)=C1 SY128876 [0,1,0,0,1,0|2,0,0]=4 315 B11R1.473 CC(C)N1N=CC(C=O)=C1I SY282268 [0,1,0,0,1,0|2,0,0]=4 316 B13R1.4 CC(C)(C)OC1=CC=C(CO)C=C1 SY015586 [0,1,0,0,0,1|0,0,2]=4 317 B13R1.4 COC1=CC=C(OC(C)(C)C)C=C1 SY298933 [0,1,0,0,0,1|2,0,0]=4 318 B13R1.4 CS(=O)(=O)NC1=CC=C(C=O)C=C1 SY003550 [0,1,0,0,0,1|2,0,0]=4 319 B13R1.4 CSC1=CC=C(OC(C)(C)C)C=C1 SY298938 [0,1,0,0,0,1|2,0,0]=4 320 B13R1.4 C[Si](C)(C)OC1=CC=C(C=O)C=C1 SY041897 [0,1,0,0,0,1|0,1,0]=3 321 B13R1.4 O=CC1=CC=C(OC(F)(F)F)C=C1 SY016250 [0,1,0,0,0,1|2,0,0]=4 322 B13R1.5 COC(=O)CC1=CC=C(C=O)C=C1 SY113262 [0,1,0,0,0,1|1,0,1]=4 323 B13R1.35 CC(C)OC1=CC=C(C=O)C(O)=C1 SY027242 [0,1,0,0,0,1|0,0,0]=2 324 B13R1.142 CC(C)OC1=CC=C(CCN)C=C1 SY028518 [0,1,0,0,0,1|1,0,1]=4 325 B13R1.585 CC(=O)C1=CC=C(OC(C)C)N=C1 SY271474 [0,1,0,0,0,1|1,0,0]=3 326 B13R1.585 CC(=O)C1=CC=C(OC(F)F)C=C1 SY050690 [0,1,0,0,0,1|2,0,0]=4 327 B13R1.585 CC(=O)NC1=CC=C(C(=O)O)C=C1 SY028998 [0,1,0,0,0,1|1,0,1]=4 328 B13R1.585 CC(C)CC1=CC=C(C(=O)O)C=C1 SY052664 [0,1,0,0,0,1|0,0,0]=2 329 B13R1.585 CC(C)CC1=CC=C([N+](=O)[O-])C=C1 SY250251 [0,1,0,0,0,1|1,0,0]=3 330 B13R1.585 CC(C)NC1=NN=C(C(=O)O)C=C1 SY028798 [0,1,0,0,0,1|2,0,0]=4 331 B13R1.585 CC(C)OC1=CC=C(B(O)O)C=C1 SY017470 [0,1,0,0,0,1|1,0,1]=4 332 B13R1.585 CC(C)OC1=CC=C(C(F)F)C=C1 SY265939 [0,1,0,0,0,1|1,0,1]=4 333 B13R1.585 CN(C)CC1=CC=C([N+](=O)[O-])C=C1 SY017308 [0,1,0,0,0,1|2,0,0]=4 334 B13R1.653 O=CC1=CC(O)=C(OC(F)F)C=C1 SY028766 [0,1,0,0,0,1|2,0,0]=4 335 B13R1.39 COC1=CC=C(C(OC)OC)C=C1 SY012039 [0,2,0,0,0,0|2,0,0]=4 336 B13R1.95 COC(=O)C1=CC=C(C=O)C=C1F SY104611 [0,2,0,0,0,0|1,0,1]=4 337 B13R1.187 COC1=CC=C(C(C)(C)C#N)C=C1 SY002170 [0,2,0,0,0,0|2,0,0]=4 338 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=C1 SY010493 [0,2,0,0,0,0|1,0,1]=4 339 B13R1.537 COC(=O)C1=CC=C(C(C)=O)C=C1 SY013110 [0,2,0,0,0,0|1,0,1]=4 340 B13R1.537 COC(=O)C1=CC=C([C@@H](C)N)C=C1 SY102794 [0,2,0,0,0,0|1,0,0]=3 341 B13R1.537 COC(=O)C1=CC=C([C@H](C)N)C=C1 SY105407 [0,2,0,0,0,0|1,0,0]=3 342 B13R1.537 O=C(O)C1=CC=C(C(=O)CBr)C=C1 SY101265 [0,2,0,0,0,0|1,0,1]=4 343 B13R1.3088 COC(=O)C1=CC=C(C=O)C(F)=C1 SY024126 [0,2,0,0,0,0|1,0,1]=4 344 B13R1.38 CC(C)(O)C1=CC=C(C#N)C(F)=C1 SY244495 [0,2,0,0,0,0|1,0,1]=4 345 B13R1.38 COC1=CC=C(C(C)(C)C)C=C1N SY274621 [0,2,0,0,0,0|2,0,0]=4 346 B13R1.38 CS(=O)(=O)C1=CC=C(C=O)C(F)=C1 SY006888 [0,2,0,0,0,0|2,0,0]=4 347 B13R1.38 O=CC1=C(F)C=C(C(F)(F)F)C=C1 SY016854 [0,2,0,0,0,0|2,0,0]=4 348 B13R1.38 O=CC1=CC=C(C(F)(F)F)C=C1Br SY023301 [0,2,0,0,0,0|2,0,0]=4 349 B13R1.38 O=CC1=CC=C(C(F)(F)F)C=C1Cl SY108220 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.38 O=CC1=CC=C(C(F)(F)F)C=C1O SY238124 [0,2,0,0,0,0|2,0,0]=4 351 B13R1.96 CS(=O)(=O)C1=CC=C(C=O)C=C1Br SY006894 [0,2,0,0,0,0|2,0,0]=4 352 B13R1.96 O=CC1=CC=C(C(F)(F)F)C(Br)=C1 SY046962 [0,2,0,0,0,0|2,0,0]=4 353 B13R1.96 O=CC1=CC=C(C(F)(F)F)C(Cl)=C1 SY105766 [0,2,0,0,0,0|2,0,0]=4 354 B13R1.96 O=CC1=CC=C(C(F)(F)F)C(F)=C1 SY061735 [0,2,0,0,0,0|2,0,0]=4 355 B13R1.140 CC(C)(C)C1=CC=C(CCO)C=C1 SY106519 [0,2,0,0,0,0|0,0,2]=4 356 B13R1.140 CC(C)(C)C1=CC=C(CON)C=C1 SY281726 [0,2,0,0,0,0|0,0,2]=4 357 B13R1.140 CC(C)(C)C1=CC=C(CON)C=C1 SY281727 [0,2,0,0,0,0|0,0,2]=4 358 B13R1.140 CC(C)(C)C1=CC=C(OCCl)C=C1 SY298494 [0,2,0,0,0,0|1,0,1]=4 359 B13R1.338 CC(=O)C1=CC=C(C(C)(C)Br)C=C1 SY249715 [0,2,0,0,0,0|0,0,0]=2 360 B13R1.338 CC(=O)C1=CC=C(C(C)(C)C)C=C1 SY017114 [0,2,0,0,0,0|0,0,0]=2 361 B13R1.338 CC(=O)C1=CC=C(S(C)(=O)=O)C=C1 SY012991 [0,2,0,0,0,0|2,0,0]=4 362 B13R1.338 CC(C)(C)C1=CC=C(B(O)O)C=C1 SY001215 [0,2,0,0,0,0|1,0,1]=4 363 B13R1.338 CC(C)(C)C1=CC=C(C(=O)O)C=C1 SY002549 [0,2,0,0,0,0|0,0,0]=2 364 B13R1.338 CC(C)(C)C1=CC=C(C(F)F)C=C1 SY265810 [0,2,0,0,0,0|1,0,1]=4 365 B13R1.338 CC(C)(C)C1=CN=C(C(=O)Cl)C=C1 SY057651 [0,2,0,0,0,0|1,0,0]=3 366 B13R1.338 CC(C)(O)C1=CC=C(B(O)O)C=C1 SY025044 [0,2,0,0,0,0|1,0,1]=4 367 B13R1.338 CC(C)(O)C1=CC=C(C(=O)O)C=C1 SY020183 [0,2,0,0,0,0|0,0,0]=2 368 B13R1.338 CC(C)C1=CC=C(S(=O)(=O)O)C=C1 SY031076 [0,2,0,0,0,0|1,0,0]=3 369 B13R1.338 CC(N)C1=CC=C(S(C)(=O)=O)C=C1 SY062694 [0,2,0,0,0,0|2,0,0]=4 370 B13R1.338 CS(=O)(=O)C1=CC=C(C(=O)O)C=C1 SY002004 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.338 C[Si](C)(C)C1=CC=C(C(=O)O)C=C1 SY096687 [0,2,0,0,0,0|0,1,0]=3 372 B13R1.338 NC(=O)C1=CC=C(C(F)(F)F)C=C1 SY035534 [0,2,0,0,0,0|2,0,0]=4 373 B13R1.338 O=C(O)C1=CC=C(C(F)(F)F)C=C1 SY001624 [0,2,0,0,0,0|2,0,0]=4 374 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(N)=C1 SY224907 [0,2,0,0,0,0|0,0,0]=2 375 B13R1.120 CC(O)C1=CC=C([N+](=O)[O-])C(F)=C1 SY246802 [0,2,0,0,0,0|2,0,0]=4 376 B13R1.120 CN(C)C1=CC=C(C(=O)O)C=C1Br SY268184 [0,2,0,0,0,0|1,0,0]=3 377 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 SY020108 [0,2,0,0,0,0|1,0,0]=3 378 B11R1.159 CC1=C(N)C(C(C)C)=CC=C1 SY058775 [0,0,1,1,0,0|2,0,0]=4 379 B11R2.34 BrC1=CC=C(C2CC2)C=C1 SY032748 [1,0,0,1,0,0|1,0,0]=3 380 B11R2.34 CC1=CC=C(C2CC2)C=C1 SY263866 [1,0,0,1,0,0|0,0,1]=3 381 B11R2.34 ClC1=CC=C(C2CC2)C=C1 SY263837 [1,0,0,1,0,0|1,0,0]=3 382 B11R2.34 FC1=CC=C(C2CC2)C=C1 SY263851 [1,0,0,1,0,0|1,0,0]=3 383 B11R2.34 FC1=CN=C(C2CC2)C=C1 SY203733 [1,0,0,1,0,0|2,0,0]=4 384 B11R2.34 NC1=CC=C(C2CC2)C=C1 SY114519 [1,0,0,1,0,0|1,0,0]=3 385 B11R2.34 O=C1C=CC(C2CC2)=NN1 SY032949 [1,0,0,1,0,0|2,0,0]=4 386 B13R2.2121 CC1=CC2=C(C=C(C=O)C=C2)N1 SY253640 [0,0,0,1,0,1|1,0,1]=4 387 B13R2.185 CCC1=CC=C(C2CNC2)C=C1 SY267293 [0,1,0,1,0,0|1,0,1]=4 388 B13R2.185 CCC1=CC=C(C2CNC2)C=C1 SY267294 [0,1,0,1,0,0|1,0,1]=4 389 B13R2.185 COC1=CC=C(C2CNC2)C=C1 SY258792 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.185 COC1=CC=C(C2CNC2)C=C1 SY267178 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.185 CSC1=CC=C(C2CNC2)C=C1 SY267350 [0,1,0,1,0,0|2,0,0]=4 392 B13R2.185 CSC1=CC=C(C2CNC2)C=C1 SY267351 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.186 COC1=CC=C(C2(N)CC2)C=C1 SY044960 [0,1,0,1,0,0|2,0,0]=4 394 B13R2.2130 CN1C=CC2=C1C=CC(C=O)=C2 SY081342 [0,1,0,1,0,0|1,0,1]=4 395 B13R2.2130 CN1N=CC2=C1C=CC(C=O)=C2 SY065445 [0,1,0,1,0,0|1,0,1]=4 396 B13R2.2396 CC1=CC(C2CC2)=CC=C1C#N SY263986 [0,1,0,1,0,0|1,0,1]=4 397 B13R2.2396 COC1=CC=C(C2CC2)C=C1C SY264045 [0,1,0,1,0,0|2,0,0]=4 398 B13R2.2396 COC1=CC=C(C2CC2)C=C1F SY263980 [0,1,0,1,0,0|2,0,0]=4 399 B13R2.2396 COC1=CC=C(C2CC2)C=C1N SY264121 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.2396 N#CC1=CC=C(C2CC2)C=C1Cl SY263905 [0,1,0,1,0,0|1,0,1]=4 401 B13R2.2396 N#CC1=CC=C(C2CC2)C=C1F SY263827 [0,1,0,1,0,0|1,0,1]=4 402 B13R2.2396 N#CC1=CC=C(C2CC2)C=C1N SY264118 [0,1,0,1,0,0|1,0,1]=4 403 B13R2.60 CCCC1=CC=C(C2CC2)C=C1 SY263987 [0,1,0,1,0,0|1,0,1]=4 404 B13R2.60 CCOC1=CC=C(C2CC2)C=C1 SY263849 [0,1,0,1,0,0|1,0,1]=4 405 B13R2.428 CN(C)C1=CC=C(C2CC2)C=C1 SY263950 [0,1,0,1,0,0|2,0,0]=4 406 B13R2.428 NC(=O)C1=CC=C(C2CC2)C=C1 SY264049 [0,1,0,1,0,0|0,0,0]=2 407 B13R2.428 O=C(O)C1=CC=C(C2CC2)C=C1 SY027669 [0,1,0,1,0,0|0,0,0]=2 408 B13R2.428 O=C(O)C1=CN=C(C2CC2)N=C1 SY024257 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.428 OB(O)C1=CC=C(C2CC2)C=C1 SY020549 [0,1,0,1,0,0|1,0,1]=4 410 B13R2.2170 COC1=CC=C(C2CC2)C(C)=C1 SY263903 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.2170 COC1=CC=C(C2CC2)C(F)=C1 SY264040 [0,1,0,1,0,0|2,0,0]=4 412 B13R2.2170 COC1=CC=C(C2CC2)C(N)=C1 SY263961 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.2170 N#CC1=CC=C(C2CC2)C(F)=C1 SY264032 [0,1,0,1,0,0|1,0,1]=4 414 B9R1.21 CCN1C=C(C=O)C=N1 SY035585 [1,0,0,0,1,0|2,0,0]=4 415 B9R1.21 O=CC1=CC(CO)=CO1 SY273711 [1,0,0,0,1,0|2,0,0]=4 416 B9R1.21 O=CC1=CC=C(CO)O1 SY010869 [1,0,0,0,1,0|2,0,0]=4 417 B11R1.20 CC(C)CC1=CC=C(N)C=C1 SY035752 [1,0,0,0,0,1|1,0,0]=3 418 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 SY262875 [1,0,0,0,0,1|1,0,0]=3 419 B11R1.20 CC(C)OC1=CC=C(N)C=C1 SY050495 [1,0,0,0,0,1|1,0,0]=3 420 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 SY225423 [1,0,0,0,0,1|2,0,0]=4 421 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 SY110382 [1,0,0,0,0,1|2,0,0]=4 422 B11R1.20 CC(C)SC1=CC=C(Cl)C=C1 SY293233 [1,0,0,0,0,1|1,0,0]=3 423 B11R1.20 CN(C)CC1=CC=C(N)C=C1 SY003571 [1,0,0,0,0,1|2,0,0]=4 424 B11R1.266 CC(C)C1=CC(C#N)=CC=N1 SY263213 [0,0,0,0,1,1|1,0,1]=4 425 B11R1.266 CN(C)C1=CC(C=O)=CC=C1 SY025191 [0,0,0,0,1,1|1,0,0]=3