0 B9R0.55 O=C(O)CCCCC(=O)O 005062 [0,0,0,0,0,0|0,0,4]=4 1 B9R0.55 O=C(O)CSSCC(=O)O 104477 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 008816 [0,0,0,1,0,0|3,0,0]=4 3 B10R1.113 CC(=O)C1=CC(C)=CC=C1 349312 [0,0,0,1,0,0|3,0,0]=4 4 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 024871 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.113 CC(=O)C1=CC(F)=CC=C1 001467 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.113 CC(=O)C1=CC(I)=CC=C1 147400 [0,0,0,1,0,0|3,0,0]=4 7 B10R1.113 CC(=O)C1=CC(N)=CC=C1 001722 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.113 CC(=O)C1=CC=CC(O)=C1 078748 [0,0,0,1,0,0|2,0,0]=3 9 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 077437 [0,0,0,1,0,0|3,0,0]=4 10 B10R1.113 CC(=O)C1=NC(C)=CC=C1 215987 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.113 CC1=CC(C(=O)Cl)=CC=C1 095026 [0,0,0,1,0,0|3,0,0]=4 12 B10R1.113 CC1=CC(C(=O)O)=CC=C1 242869 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.113 CC1=CC(C(=O)O)=CC=N1 045782 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.113 CC1=CC(C(N)=O)=CC=C1 324085 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.113 CC1=CC=CC(C(=O)O)=N1 011322 [0,0,0,1,0,0|2,0,0]=3 16 B10R1.113 CC1=CN=CC(C(=O)O)=C1 024697 [0,0,0,1,0,0|3,0,0]=4 17 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 036153 [0,0,0,1,0,0|3,0,0]=4 18 B10R1.113 NC(=O)C1=CC(F)=CC=C1 006180 [0,0,0,1,0,0|3,0,0]=4 19 B10R1.113 NC(=O)C1=CC(I)=CC=C1 036159 [0,0,0,1,0,0|3,0,0]=4 20 B10R1.113 NC(=O)C1=CC(N)=CC=C1 018167 [0,0,0,1,0,0|3,0,0]=4 21 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 018356 [0,0,0,1,0,0|3,0,0]=4 22 B10R1.113 NC(=O)C1=NC(F)=CC=C1 013003 [0,0,0,1,0,0|3,0,0]=4 23 B10R1.113 NC1=CC(C(=O)O)=CC=C1 078487 [0,0,0,1,0,0|2,0,0]=3 24 B10R1.113 NC1=CC(C(=O)O)=CC=N1 045247 [0,0,0,1,0,0|3,0,0]=4 25 B10R1.113 NC1=CC(C(=O)O)=NC=C1 066080 [0,0,0,1,0,0|3,0,0]=4 26 B10R1.113 NC1=CN=CC(C(=O)O)=C1 024647 [0,0,0,1,0,0|3,0,0]=4 27 B10R1.113 NC1=NC(C(=O)O)=CC=C1 033257 [0,0,0,1,0,0|2,0,0]=3 28 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 024397 [0,0,0,1,0,0|3,0,0]=4 29 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 098670 [0,0,0,1,0,0|3,0,0]=4 30 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 001641 [0,0,0,1,0,0|3,0,0]=4 31 B10R1.113 O=C(Cl)C1=CC=CC(I)=C1 014704 [0,0,0,1,0,0|3,0,0]=4 32 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 109800 [0,0,0,1,0,0|2,0,0]=3 33 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 009061 [0,0,0,1,0,0|3,0,0]=4 34 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 024767 [0,0,0,1,0,0|3,0,0]=4 35 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 043669 [0,0,0,1,0,0|3,0,0]=4 36 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 010413 [0,0,0,1,0,0|3,0,0]=4 37 B10R1.113 O=C(O)C1=CC(F)=CC=C1 002167 [0,0,0,1,0,0|2,0,0]=3 38 B10R1.113 O=C(O)C1=CC(F)=NC=C1 005468 [0,0,0,1,0,0|3,0,0]=4 39 B10R1.113 O=C(O)C1=CC(I)=CC=C1 147800 [0,0,0,1,0,0|2,0,0]=3 40 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 078545 [0,0,0,1,0,0|2,0,0]=3 41 B10R1.113 O=C(O)C1=CC=CC(F)=N1 005466 [0,0,0,1,0,0|2,0,0]=3 42 B10R1.113 O=C(O)C1=CC=CC(O)=C1 208854 [0,0,0,1,0,0|1,0,0]=2 43 B10R1.113 O=C(O)C1=CC=CC(O)=N1 045246 [0,0,0,1,0,0|1,0,0]=2 44 B10R1.113 O=C(O)C1=CC=NC(O)=C1 043645 [0,0,0,1,0,0|2,0,0]=3 45 B10R1.113 O=C(O)C1=CN=CC(F)=C1 035868 [0,0,0,1,0,0|3,0,0]=4 46 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 021278 [0,0,0,1,0,0|2,0,0]=3 47 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 013139 [0,0,0,1,0,0|2,0,0]=3 48 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 062993 [0,0,0,1,0,0|3,0,0]=4 49 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 036988 [0,0,0,1,0,0|3,0,0]=4 50 B10R1.113 O=C(O)C1=NC=CC(O)=C1 093182 [0,0,0,1,0,0|2,0,0]=3 51 B10R1.113 O=C(O)C1=NC=NC(O)=C1 076404 [0,0,0,1,0,0|3,0,0]=4 52 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 024562 [0,0,0,1,0,0|2,0,1]=4 53 B10R1.113 OB(O)C1=CC(O)=CC=C1 024329 [0,0,0,1,0,0|2,0,1]=4 54 B8R0.28 O=C(O)CCCC(=O)O 143400 [0,0,0,0,1,0|0,0,3]=4 55 B8R0.28 O=C(O)CNCC(=O)O 358251 [0,0,0,0,1,0|1,0,2]=4 56 B8R0.28 O=C(O)COCC(=O)O 099137 [0,0,0,0,1,0|1,0,2]=4 57 B8R0.28 O=C(O)CSCC(=O)O 099003 [0,0,0,0,1,0|1,0,2]=4 58 B7R0.1 CC\C=C\C=C\C=O 242611 [2,0,0,0,0,0|1,0,1]=4 59 B7R0.4 C\C=C\C=C\C(=O)O 104773 [2,0,0,0,0,0|0,0,1]=3 60 B9R0.7 O=C(O)CCC(=O)C(=O)O 069250 [0,1,0,0,1,0|0,0,2]=4 61 B9R1.2 C(=O)C1=CC(Br)=CC=C1 003060 [1,0,0,1,0,0|2,0,0]=4 62 B9R1.2 C(=O)C1=CC(C)=CC=C1 001390 [1,0,0,1,0,0|2,0,0]=4 63 B9R1.2 CC1=CC=CC(C=O)=N1 021900 [1,0,0,1,0,0|2,0,0]=4 64 B9R1.2 O=CC1=CC(Cl)=CC=C1 032762 [1,0,0,1,0,0|2,0,0]=4 65 B9R1.2 O=CC1=CC(F)=CC=C1 001668 [1,0,0,1,0,0|2,0,0]=4 66 B9R1.2 O=CC1=CC(O)=CC=C1 044196 [1,0,0,1,0,0|1,0,0]=3 67 B9R1.2 O=CC1=CC=CC(I)=C1 079137 [1,0,0,1,0,0|2,0,0]=4 68 B9R1.2 O=CC1=NC(Br)=CC=C1 011583 [1,0,0,1,0,0|2,0,0]=4 69 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [1,0,0,1,0,0|2,0,0]=4 70 B9R1.6 CC(=O)C1=NC=CC=C1 044389 [1,0,0,1,0,0|2,0,0]=4 71 B9R1.6 NC(=O)C1=CC=CC=C1 099462 [1,0,0,1,0,0|2,0,0]=4 72 B9R1.6 NC(=O)C1=NC=CC=C1 235663 [1,0,0,1,0,0|2,0,0]=4 73 B9R1.6 O=C(Cl)C1=CC=CC=C1 097787 [1,0,0,1,0,0|2,0,0]=4 74 B9R1.6 O=C(Cl)C1=CC=CC=C1 102565 [1,0,0,1,0,0|2,0,0]=4 75 B9R1.6 O=C(Cl)C1=NC=CC=C1 166500 [1,0,0,1,0,0|2,0,0]=4 76 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [1,0,0,1,0,0|1,0,0]=3 77 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [1,0,0,1,0,0|1,0,0]=3 78 B9R1.6 O=C(O)C1=CC=CN=C1 106451 [1,0,0,1,0,0|2,0,0]=4 79 B9R1.6 O=C(O)C1=CC=NC=C1 045226 [1,0,0,1,0,0|2,0,0]=4 80 B9R1.6 O=C(O)C1=CN=CC=C1 214893 [1,0,0,1,0,0|2,0,0]=4 81 B9R1.6 O=C(O)C1=NC=CC=C1 043385 [1,0,0,1,0,0|1,0,0]=3 82 B9R1.6 O=C(O)C1=NC=CC=N1 043596 [1,0,0,1,0,0|2,0,0]=4 83 B9R1.6 O=C(O)C1=NC=CN=C1 066244 [1,0,0,1,0,0|2,0,0]=4 84 B9R1.6 O=C(O)C1=NC=NC=C1 066253 [1,0,0,1,0,0|2,0,0]=4 85 B9R1.6 O=C(O)C1=NN=CC=C1 047653 [1,0,0,1,0,0|2,0,0]=4 86 B9R1.6 O=C([O-])C1=CC=CC=C1 094455 [1,0,0,1,0,0|1,0,1]=4 87 B9R1.6 O=C([O-])C1=CC=CC=C1 095369 [1,0,0,1,0,0|1,0,1]=4 88 B9R1.6 O=C([O-])C1=CC=CC=C1 099144 [1,0,0,1,0,0|1,0,1]=4 89 B9R1.6 O=C([O-])C1=CC=CC=C1 239403 [1,0,0,1,0,0|1,0,1]=4 90 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [1,0,0,1,0,0|2,0,0]=4 91 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [1,0,0,1,0,0|2,0,0]=4 92 B9R1.13 O=C(O)CC1=CC=CS1 044684 [1,0,0,1,0,0|0,1,1]=4 93 B9R1.41 CC1=C(C(=O)O)C=CS1 066125 [1,0,0,1,0,0|2,0,0]=4 94 B9R1.41 CC1=C(C(=O)O)SC=C1 045075 [1,0,0,1,0,0|2,0,0]=4 95 B9R1.41 CC1=CSC=C1C(=O)O 224039 [1,0,0,1,0,0|2,0,0]=4 96 B9R1.41 CN1C=CC=C1C(=O)O 093156 [1,0,0,1,0,0|2,0,0]=4 97 B9R1.41 O=C(O)C1=C(Br)C=CS1 019423 [1,0,0,1,0,0|2,0,0]=4 98 B9R1.41 O=C(O)C1=C(Br)SC=C1 092319 [1,0,0,1,0,0|2,0,0]=4 99 B9R1.41 O=C(O)C1=C(Cl)C=CS1 017407 [1,0,0,1,0,0|2,0,0]=4 100 B9R1.41 O=C(O)C1=C(Cl)SC=C1 077280 [1,0,0,1,0,0|2,0,0]=4 101 B9R1.41 O=C(O)C1=C(I)C=CS1 021666 [1,0,0,1,0,0|2,0,0]=4 102 B9R1.35 CC1=CC=C(C(=O)O)O1 014513 [0,0,0,1,1,0|1,0,0]=3 103 B9R1.35 CC1=CC=C(C(=O)O)S1 045076 [0,0,0,1,1,0|1,1,0]=4 104 B9R1.35 CC1=NC=C(C(=O)O)O1 227751 [0,0,0,1,1,0|2,0,0]=4 105 B9R1.35 O=C(O)C1=CC=C(Br)O1 020339 [0,0,0,1,1,0|1,0,0]=3 106 B9R1.35 O=C(O)C1=CC=C(Br)S1 114300 [0,0,0,1,1,0|1,1,0]=4 107 B9R1.35 O=C(O)C1=CC=C(Cl)S1 014515 [0,0,0,1,1,0|1,1,0]=4 108 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 060504 [0,0,0,1,0,1|1,0,0]=3 109 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 001325 [0,0,0,1,0,1|2,0,0]=4 110 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 043387 [0,0,0,1,0,1|2,0,0]=4 111 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 001134 [0,0,0,1,0,1|2,0,0]=4 112 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 046146 [0,0,0,1,0,1|2,0,0]=4 113 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 001293 [0,0,0,1,0,1|2,0,0]=4 114 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 079029 [0,0,0,1,0,1|1,0,0]=3 115 B11R1.178 O=C(O)C1=C(C(=O)O)NC=N1 009677 [0,0,0,1,0,1|1,0,0]=3 116 B11R1.178 O=C(O)C1=CSC=C1C(=O)O 076009 [0,0,0,1,0,1|0,0,0]=2 117 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 003630 [0,1,0,1,0,0|1,0,1]=4 118 B11R1.23 COC(=O)C1=CC(C)=CC=C1 358396 [0,1,0,1,0,0|2,0,0]=4 119 B11R1.23 COC(=O)C1=CC(F)=CC=C1 009502 [0,1,0,1,0,0|2,0,0]=4 120 B11R1.23 COC(=O)C1=CC(I)=CC=C1 037328 [0,1,0,1,0,0|2,0,0]=4 121 B11R1.23 COC(=O)C1=CC(O)=CN=C1 009282 [0,1,0,1,0,0|2,0,0]=4 122 B11R1.23 COC(=O)C1=CC=CC(=O)N1 231201 [0,1,0,1,0,0|1,0,0]=3 123 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 155102 [0,1,0,1,0,0|2,0,0]=4 124 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 049693 [0,1,0,1,0,0|2,0,0]=4 125 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 243026 [0,1,0,1,0,0|2,0,0]=4 126 B11R1.23 COC(=O)C1=CC=CC(N)=C1 038247 [0,1,0,1,0,0|2,0,0]=4 127 B11R1.23 COC(=O)C1=CC=CC(O)=C1 078900 [0,1,0,1,0,0|1,0,0]=3 128 B11R1.23 COC(=O)C1=NC(C)=CC=C1 032619 [0,1,0,1,0,0|2,0,0]=4 129 B11R1.23 COC(=O)C1=NC(N)=CC=C1 078136 [0,1,0,1,0,0|2,0,0]=4 130 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 018714 [0,1,0,1,0,0|2,0,0]=4 131 B11R1.23 N\C(=N/O)C1=CC(O)=CC=C1 351668 [0,1,0,1,0,0|2,0,0]=4 132 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 080350 [0,1,0,1,0,0|2,0,0]=4 133 B11R1.159 CC(=O)C1=CC=CC(N)=C1O 040162 [0,1,0,1,0,0|2,0,0]=4 134 B11R1.159 CC(=O)C1=CC=CC(O)=C1O 093041 [0,1,0,1,0,0|1,0,1]=4 135 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O 018295 [0,1,0,1,0,0|2,0,0]=4 136 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl 011627 [0,1,0,1,0,0|2,0,0]=4 137 B11R1.159 CC1=C(C(=O)O)C=CC=C1I 018744 [0,1,0,1,0,0|2,0,0]=4 138 B11R1.159 CC1=C(F)C=CC=C1C(=O)O 037153 [0,1,0,1,0,0|2,0,0]=4 139 B11R1.159 CC1=C(N)C=CC=C1C(=O)O 078644 [0,1,0,1,0,0|2,0,0]=4 140 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 079044 [0,1,0,1,0,0|1,0,0]=3 141 B11R1.159 CC1=C(O)C=CC=C1C(=O)O 078643 [0,1,0,1,0,0|1,0,0]=3 142 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 112800 [0,1,0,1,0,0|2,0,0]=4 143 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 001048 [0,1,0,1,0,0|2,0,0]=4 144 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl 120200 [0,1,0,1,0,0|2,0,0]=4 145 B11R1.159 CC1=CC=CC(C(=O)O)=C1F 034859 [0,1,0,1,0,0|2,0,0]=4 146 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 148700 [0,1,0,1,0,0|2,0,0]=4 147 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 023905 [0,1,0,1,0,0|2,0,0]=4 148 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O 040654 [0,1,0,1,0,0|2,0,0]=4 149 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 040187 [0,1,0,1,0,0|2,0,0]=4 150 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O 077502 [0,1,0,1,0,0|2,0,0]=4 151 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 037148 [0,1,0,1,0,0|2,0,0]=4 152 B11R1.159 NC1=C(I)C=CC=C1C(=O)O 091956 [0,1,0,1,0,0|2,0,0]=4 153 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 077960 [0,1,0,1,0,0|1,0,0]=3 154 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 329962 [0,1,0,1,0,0|1,0,0]=3 155 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 005469 [0,1,0,1,0,0|2,0,0]=4 156 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 062765 [0,1,0,1,0,0|2,0,0]=4 157 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 001164 [0,1,0,1,0,0|2,0,0]=4 158 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 005185 [0,1,0,1,0,0|2,0,0]=4 159 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 005473 [0,1,0,1,0,0|2,0,0]=4 160 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 004429 [0,1,0,1,0,0|2,0,0]=4 161 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 001858 [0,1,0,1,0,0|2,0,0]=4 162 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 038269 [0,1,0,1,0,0|2,0,0]=4 163 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 013028 [0,1,0,1,0,0|1,0,0]=3 164 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O 076295 [0,1,0,1,0,0|1,0,0]=3 165 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br 038275 [0,1,0,1,0,0|2,0,0]=4 166 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O 079645 [0,1,0,1,0,0|1,0,0]=3 167 B11R1.159 O=C(O)C1=CC=CC(O)=C1O 092005 [0,1,0,1,0,0|0,0,1]=3 168 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 047534 [0,1,0,1,0,0|2,0,0]=4 169 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 240694 [0,1,0,1,0,0|2,0,0]=4 170 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 325484 [0,1,0,1,0,0|2,0,0]=4 171 B11R1.266 COC1=CC(C(=O)Cl)=CC=C1 018779 [0,1,0,1,0,0|2,0,0]=4 172 B11R1.266 COC1=CC(C(=O)O)=CC=C1 334012 [0,1,0,1,0,0|1,0,0]=3 173 B11R1.266 COC1=CC(C(=O)O)=NC=C1 077250 [0,1,0,1,0,0|2,0,0]=4 174 B11R1.266 COC1=CC=CC(C(C)=O)=C1 021712 [0,1,0,1,0,0|2,0,0]=4 175 B11R1.266 COC1=CC=CC(C(N)=O)=C1 545201 [0,1,0,1,0,0|2,0,0]=4 176 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 013809 [0,1,0,1,0,0|2,0,0]=4 177 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 037338 [0,1,0,1,0,0|2,0,0]=4 178 B11R1.266 NNC1=CC(C(=O)O)=CC=C1 092194 [0,1,0,1,0,0|2,0,0]=4 179 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 043285 [0,1,0,1,0,0|2,0,0]=4 180 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 077878 [0,1,0,1,0,0|2,0,0]=4 181 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 078661 [0,1,0,1,0,0|1,0,0]=3 182 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 021304 [0,1,0,1,0,0|2,0,0]=4 183 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 038171 [0,1,0,1,0,0|2,0,0]=4 184 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 037423 [0,1,0,1,0,0|2,0,0]=4 185 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 037650 [0,1,0,1,0,0|2,0,0]=4 186 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 037154 [0,1,0,1,0,0|2,0,0]=4 187 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 038167 [0,1,0,1,0,0|2,0,0]=4 188 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 038164 [0,1,0,1,0,0|2,0,0]=4 189 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 005475 [0,1,0,1,0,0|2,0,0]=4 190 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 005560 [0,1,0,1,0,0|2,0,0]=4 191 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 005181 [0,1,0,1,0,0|2,0,0]=4 192 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 033365 [0,1,0,1,0,0|2,0,0]=4 193 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 001417 [0,1,0,1,0,0|2,0,0]=4 194 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 112001 [0,1,0,1,0,0|2,0,0]=4 195 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 011691 [0,1,0,1,0,0|2,0,0]=4 196 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 209189 [0,1,0,1,0,0|1,0,0]=3 197 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 235192 [0,1,0,1,0,0|1,0,0]=3 198 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 049501 [0,1,0,1,0,0|2,0,0]=4 199 B11R1.74 O=C1C=C(C(=O)O)C=C(O)N1 056519 [0,1,0,1,0,0|2,0,0]=4 200 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 103808 [0,1,0,1,0,0|2,0,0]=4 201 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 216637 [0,1,0,1,0,0|2,0,0]=4 202 B11R1.167 CC(=O)C1=CC(O)=CC=C1O 079189 [0,1,0,1,0,0|2,0,0]=4 203 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 042885 [0,1,0,1,0,0|2,0,0]=4 204 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 002249 [0,1,0,1,0,0|2,0,0]=4 205 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 112810 [0,1,0,1,0,0|2,0,0]=4 206 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 044556 [0,1,0,1,0,0|2,0,0]=4 207 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 013846 [0,1,0,1,0,0|2,0,0]=4 208 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 148705 [0,1,0,1,0,0|2,0,0]=4 209 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 011365 [0,1,0,1,0,0|2,0,0]=4 210 B11R1.167 CC1=CC=C(Cl)C=C1C(=O)O 018395 [0,1,0,1,0,0|2,0,0]=4 211 B11R1.167 CC1=CC=C(I)C=C1C(=O)O 038168 [0,1,0,1,0,0|2,0,0]=4 212 B11R1.167 CC1=CC=C(O)C(C(=O)O)=C1 222122 [0,1,0,1,0,0|2,0,0]=4 213 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 018242 [0,1,0,1,0,0|2,0,0]=4 214 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 011364 [0,1,0,1,0,0|2,0,0]=4 215 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 003126 [0,1,0,1,0,0|2,0,0]=4 216 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 011772 [0,1,0,1,0,0|1,0,0]=3 217 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 020066 [0,1,0,1,0,0|2,0,0]=4 218 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 005488 [0,1,0,1,0,0|2,0,0]=4 219 B11R1.167 NC1=CC=C(I)C=C1C(=O)O 065839 [0,1,0,1,0,0|2,0,0]=4 220 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 065629 [0,1,0,1,0,0|2,0,0]=4 221 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 005471 [0,1,0,1,0,0|2,0,0]=4 222 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 112000 [0,1,0,1,0,0|2,0,0]=4 223 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 075288 [0,1,0,1,0,0|2,0,0]=4 224 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=N1 045805 [0,1,0,1,0,0|2,0,0]=4 225 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 008647 [0,1,0,1,0,0|2,0,0]=4 226 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 009093 [0,1,0,1,0,0|2,0,0]=4 227 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 005477 [0,1,0,1,0,0|2,0,0]=4 228 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 005182 [0,1,0,1,0,0|2,0,0]=4 229 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 001934 [0,1,0,1,0,0|2,0,0]=4 230 B11R1.167 O=C(O)C1=C(F)C=CC(F)=N1 045836 [0,1,0,1,0,0|2,0,0]=4 231 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 013023 [0,1,0,1,0,0|2,0,0]=4 232 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 112100 [0,1,0,1,0,0|2,0,0]=4 233 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 119810 [0,1,0,1,0,0|2,0,0]=4 234 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 001665 [0,1,0,1,0,0|2,0,0]=4 235 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 236790 [0,1,0,1,0,0|1,0,0]=3 236 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O 078566 [0,1,0,1,0,0|2,0,0]=4 237 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Br 018255 [0,1,0,1,0,0|2,0,0]=4 238 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Cl 079000 [0,1,0,1,0,0|2,0,0]=4 239 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1O 079860 [0,1,0,1,0,0|2,0,0]=4 240 B11R1.167 O=C(O)C1=CC(I)=CC=C1I 005559 [0,1,0,1,0,0|2,0,0]=4 241 B11R1.167 O=C(O)C1=CC(I)=CC=C1O 216852 [0,1,0,1,0,0|2,0,0]=4 242 B11R1.167 O=C(O)C1=CC(O)=CC=C1I 305547 [0,1,0,1,0,0|1,0,0]=3 243 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br 078244 [0,1,0,1,0,0|2,0,0]=4 244 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 002544 [0,1,0,1,0,0|2,0,0]=4 245 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 044555 [0,1,0,1,0,0|2,0,0]=4 246 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 120215 [0,1,0,1,0,0|2,0,0]=4 247 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 001468 [0,1,0,1,0,0|2,0,0]=4 248 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 005790 [0,1,0,1,0,0|2,0,0]=4 249 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 013858 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 018745 [0,1,0,1,0,0|2,0,0]=4 251 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 047883 [0,1,0,1,0,0|2,0,0]=4 252 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 019461 [0,1,0,1,0,0|2,0,0]=4 253 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 018719 [0,1,0,1,0,0|2,0,0]=4 254 B11R1.21 CC1=CC(C(=O)O)=CC=C1Br 018296 [0,1,0,1,0,0|2,0,0]=4 255 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl 018394 [0,1,0,1,0,0|2,0,0]=4 256 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br 075171 [0,1,0,1,0,0|2,0,0]=4 257 B11R1.21 CN1C=CC(C(=O)O)=CC1=O 041839 [0,1,0,1,0,0|2,0,0]=4 258 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 065847 [0,1,0,1,0,0|2,0,0]=4 259 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 021888 [0,1,0,1,0,0|2,0,0]=4 260 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 033910 [0,1,0,1,0,0|2,0,0]=4 261 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 013032 [0,1,0,1,0,0|2,0,0]=4 262 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 065683 [0,1,0,1,0,0|1,0,0]=3 263 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 065840 [0,1,0,1,0,0|2,0,0]=4 264 B11R1.21 NC1=CC=C(C(=O)O)C=C1N 003415 [0,1,0,1,0,0|2,0,0]=4 265 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 005474 [0,1,0,1,0,0|2,0,0]=4 266 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 038131 [0,1,0,1,0,0|2,0,0]=4 267 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 127105 [0,1,0,1,0,0|2,0,0]=4 268 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 002149 [0,1,0,1,0,0|2,0,0]=4 269 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 005476 [0,1,0,1,0,0|2,0,0]=4 270 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 005183 [0,1,0,1,0,0|2,0,0]=4 271 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 002080 [0,1,0,1,0,0|2,0,0]=4 272 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 013030 [0,1,0,1,0,0|2,0,0]=4 273 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 119801 [0,1,0,1,0,0|2,0,0]=4 274 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 048775 [0,1,0,1,0,0|1,0,0]=3 275 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 065618 [0,1,0,1,0,0|1,0,0]=3 276 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 009206 [0,1,0,1,0,0|1,0,0]=3 277 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 043464 [0,1,0,1,0,0|1,0,0]=3 278 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 110500 [0,1,0,1,0,0|2,0,0]=4 279 B11R1.21 O=C(O)C1=CC=C(I)C(F)=C1 078055 [0,1,0,1,0,0|2,0,0]=4 280 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 078581 [0,1,0,1,0,0|1,0,0]=3 281 B11R1.21 O=C(O)C1=CC=C(O)C(Br)=C1 240961 [0,1,0,1,0,0|2,0,0]=4 282 B11R1.175 CC(=O)C1=CC=C(C(=O)O)S1 225758 [0,1,0,1,0,0|1,0,0]=3 283 B11R1.175 O=C(O)C1=CC(C(=O)O)=NN1 226572 [0,1,0,1,0,0|2,0,0]=4 284 B11R1.175 O=C(O)C1=CC=C(C(=O)O)N1 209167 [0,1,0,1,0,0|0,0,0]=2 285 B11R1.175 O=C(O)C1=CC=C(C(=O)O)O1 043251 [0,1,0,1,0,0|0,0,0]=2 286 B11R1.175 O=C(O)C1=CC=C(C(=O)O)S1 013724 [0,1,0,1,0,0|0,0,0]=2 287 B11R1.175 O=C(O)C1=CC=C([N+](=O)[O-])S1 066106 [0,1,0,1,0,0|1,0,1]=4 288 B7R0.6 O=C(Cl)\C=C\C(=O)Cl 099388 [0,0,0,0,2,0|2,0,0]=4 289 B7R0.6 O=C(O)CCC(=O)O 104604 [0,0,0,0,2,0|0,0,2]=4 290 B7R0.6 O=C(O)CCC(=O)O 239121 [0,0,0,0,2,0|0,0,2]=4 291 B7R0.6 O=C(O)\C=C/C(=O)O 152300 [0,0,0,0,2,0|0,0,0]=2 292 B7R0.6 O=C(O)\C=C\C(=O)O 094517 [0,0,0,0,2,0|0,0,0]=2