0 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.13 CC(=O)C1=CN=C(C=C1)Br Z1269224642 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl Z1201622182 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 CC(=O)C1=CN=C(C=C1)F Z1198173101 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.13 CC(=O)C1=NC=C(C=C1)Br Z1945984212 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.13 CC(=O)C1=NC=C(C=C1)Cl Z1198173098 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.13 CC(=O)C1=NC=C(C=C1)F Z1575143877 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.13 CC(C)C1=CC=C(C=C1)Br Z732229746 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.13 CC(C)C1=CC=C(C=C1)Cl Z1255372793 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.13 CC(C)C1=CC=C(C=C1)N Z104476320 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.13 CC(C)C1=CC=C(C=C1)O Z56347200 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 CC(N)C1=CC=C(C=C1)Br Z56347162 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.13 CC(N)C1=CC=C(C=C1)Cl Z56347112 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.13 CC(N)C1=CN=C(C=C1)O Z4423361180 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.13 CC(O)C1=CC=C(C=C1)Br Z335244904 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.13 CC(O)C1=CC=C(C=C1)Cl Z104479788 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 CC(O)C1=CC=C(C=C1)F Z56347219 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 CC(O)C1=CC=C(C=C1)I Z228586282 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.13 CC1=CC=C(C=C1)B(O)O Z336079532 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.13 CC1=CC=C(C=C1)C(=N)N Z1405445841 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.13 CC1=CC=C(C=C1)C(=S)N Z56939152 [0,0,0,0,0,0|3,1,0]=4 29 B10R1.13 CC1=CC=C(C=C1)C(C)C Z104497772 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] Z104476692 [0,0,0,0,0,0|1,0,0]=1 33 B10R1.13 CC1=CC=C(C=C1)[S-](=O)=O Z104501328 [0,0,0,0,0,0|2,0,1]=3 34 B10R1.13 CC1=CN=C(C=C1)C(=O)O Z1511494596 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.13 CC1=NC=C(C=C1)C(=O)N Z57493539 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.13 CC1=NC=C(C=C1)C(=O)O Z235485476 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.13 CN(C)C1=CC=C(C=C1)O Z137981254 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)Br Z850973968 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)I Z360055808 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.13 C[C@H](N)C1=CC=C(C=C1)Br Z1869802525 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.13 C[C@H](N)C1=CC=C(C=C1)I Z1696091699 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 C[C@H](O)C1=CC=C(C=C1)Br Z850973970 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.13 C[C@H](O)C1=CC=C(C=C1)I Z360055806 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.13 N=C(N)C1=CC=C(C=C1)Br Z1263602346 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 N=C(N)C1=CC=C(C=C1)Cl Z56771179 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.13 N=C(N)C1=CC=C(C=C1)F Z2289798423 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.13 N=C(N)C1=CC=C(C=C1)I Z2574914411 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.13 NC(=O)C1=CN=C(C=C1)Cl Z33546654 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.13 NC(=O)C1=CN=C(C=C1)F Z1183725924 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.13 NC(=O)C1=CN=C(C=C1)N Z959893184 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.13 NC(=O)C1=CNC(=O)C=C1 Z220564282 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.13 NC(=O)C1=NC=C(C=C1)Br Z1065600734 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.13 NC(=O)C1=NC=C(C=C1)I Z1269145218 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.13 NC(=O)C1=NC=C(C=C1)N Z1116403989 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.13 NC(=S)C1=CC=C(C=C1)Br Z56964597 [0,0,0,0,0,0|3,1,0]=4 64 B10R1.13 NC(=S)C1=CC=C(C=C1)Cl Z57070431 [0,0,0,0,0,0|3,1,0]=4 65 B10R1.13 NC(=S)C1=CC=C(C=C1)N Z234895465 [0,0,0,0,0,0|3,1,0]=4 66 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [0,0,0,0,0,0|2,1,0]=3 67 B10R1.13 NC1=CC=C(C=C1)B(O)O Z1741970842 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [0,0,0,0,0,0|2,0,1]=3 69 B10R1.13 NC1=CC=C(C=C1)C(F)F Z2900188029 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.13 NC1=CC=C(C=C1)[N+](=O)[O-] Z275127984 [0,0,0,0,0,0|1,0,0]=1 71 B10R1.13 NC1=CN=C(C=C1)C(=O)O Z1649677869 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.13 NC1=NC=C(C=C1)C(=O)O Z90122558 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.13 O=C(Cl)C1=CN=C(C=C1)Cl Z1255461313 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.13 O=C(F)C1=CN=C(C=C1)F Z2471610470 [0,0,0,0,0,0|4,0,0]=4 75 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [0,0,0,0,0,0|2,0,1]=3 76 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [0,0,0,0,0,0|2,0,1]=3 77 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [0,0,0,0,0,0|2,0,1]=3 78 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [0,0,0,0,0,0|2,0,1]=3 79 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [0,0,0,0,0,0|1,0,1]=2 80 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [0,0,0,0,0,0|1,1,1]=3 81 B10R1.13 O=C(O)C1=CN=C(C=C1)Br Z1258919772 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.13 O=C(O)C1=CN=C(C=C1)Cl Z104476110 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.13 O=C(O)C1=CN=C(C=C1)F Z1182395505 [0,0,0,0,0,0|3,0,1]=4 84 B10R1.13 O=C(O)C1=CN=C(C=C1)O Z104500708 [0,0,0,0,0,0|2,0,1]=3 85 B10R1.13 O=C(O)C1=NC=C(C=C1)Br Z972791012 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl Z1201622823 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.13 O=C(O)C1=NC=C(C=C1)I Z1069125846 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.13 O=C1C=CC(=CN1)[N+](=O)[O-] Z56347228 [0,0,0,0,0,0|1,0,1]=2 89 B10R1.13 O=C1C=CC(=CO1)C(=O)O Z104472302 [0,0,0,0,0,0|2,0,2]=4 90 B10R1.13 O=P(O)C1=CC=C(C=C1)Cl Z56798029 [0,0,0,0,0,0|1,1,1]=3 91 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Br Z104474532 [0,0,0,0,0,0|1,0,0]=1 92 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Cl Z104474568 [0,0,0,0,0,0|1,0,0]=1 93 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)I Z56924538 [0,0,0,0,0,0|1,0,0]=1 94 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [0,0,0,0,0,0|0,0,0]=0 95 B10R1.13 O=[N+]([O-])C1=CC=[N+](C=C1)[O-] Z56755636 [0,0,0,0,0,0|1,0,1]=2 96 B10R1.13 O=[N+]([O-])C1=CN=C(C=C1)Cl Z57834470 [0,0,0,0,0,0|2,0,0]=2 97 B10R1.13 O=[N+]([O-])C1=CN=C(C=C1)S Z111423212 [0,0,0,0,0,0|1,1,0]=2 98 B10R1.13 O=[N+]([O-])C1=CN=C(N=C1)Cl Z733881170 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.13 O=[N+]([O-])C1=NC=C(C=C1)Br Z361899954 [0,0,0,0,0,0|2,0,0]=2 100 B10R1.13 O=[N+]([O-])C1=NC=C(C=C1)Cl Z104475594 [0,0,0,0,0,0|2,0,0]=2 101 B10R1.13 OB(O)C1=CC=C(C=C1)Br Z1169350731 [0,0,0,0,0,0|2,0,2]=4 102 B10R1.13 OB(O)C1=CC=C(C=C1)Cl Z295122658 [0,0,0,0,0,0|2,0,2]=4 103 B10R1.13 OB(O)C1=CC=C(C=C1)F Z381540956 [0,0,0,0,0,0|2,0,2]=4 104 B10R1.13 OB(O)C1=CC=C(C=C1)O Z336080006 [0,0,0,0,0,0|1,0,2]=3 105 B10R1.13 OC1=NC=C(C=C1)C(F)F Z1726130896 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.1 CC1=CC=C(C=C1)C#N Z56965882 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.1 CC1=CC=C(C=C1)C=O Z104477698 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.1 CC1=CN=C(C=C1)C=O Z1198172069 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.1 CC1=NC=C(C=C1)C=O Z744849420 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [1,0,0,0,0,0|1,0,1]=3 116 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.1 FC1=CC=C(C=C1)CBr Z89269613 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.1 N#CC1=CC=C(C=C1)Br Z55928801 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 N#CC1=CC=C(C=C1)Cl Z56942044 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 N#CC1=CC=C(C=C1)I Z57899725 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.1 N#CC1=CC=C(C=C1)N Z57073771 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.1 NCC1=CC=C(C=C1)F Z54748266 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.1 NNC1=CC=C(C=C1)Cl Z56776889 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.1 O=CC1=CC=C(C=C1)Br Z57162109 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.1 O=CC1=CC=C(C=C1)Cl Z57772447 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.1 O=CC1=CC=C(C=C1)F Z104472914 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.1 O=CC1=CC=C(C=C1)I Z57887684 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.1 O=CC1=CC=C(C=C1)S Z1198150788 [1,0,0,0,0,0|1,1,0]=3 139 B9R1.1 O=CC1=CN=C(C=C1)O Z1741969170 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.1 O=CC1=NC=C(C=C1)Br Z1079442796 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 O=CC1=NC=C(C=C1)Cl Z1198177123 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.1 O=CC1=NC=C(C=C1)F Z1201624239 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.1 O=CC1=NC=C(C=C1)O Z1741979912 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.1 OCC1=CC=C(C=C1)Br Z335244742 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.1 OCC1=CC=C(C=C1)Cl Z104478032 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.1 OCC1=CC=C(C=C1)F Z104477460 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.1 OCC1=CC=C(C=C1)I Z385370342 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.1 SCC1=CC=C(C=C1)Cl Z55948216 [1,0,0,0,0,0|2,1,0]=4 150 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [1,0,0,0,0,0|2,1,0]=4 164 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [1,0,0,0,0,0|1,0,1]=3 165 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.6 O=[N+]([O-])C1=NC=CC=C1 Z361899950 [1,0,0,0,0,0|1,0,0]=2 169 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [1,0,0,0,0,0|1,0,1]=3 170 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [1,0,0,0,0,0|1,0,2]=4 171 B11R1.3 C#CC1=CC=C(C=C1)C(=O)N Z1203579154 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.3 C#CC1=CC=C(C=C1)[N+](=O)[O-] Z431535574 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.3 C=CC1=CC=C(C=C1)C(=O)N Z1203578780 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N Z56820417 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.3 CC(=O)C1=CC=C(C=C1)CN Z3018118044 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.3 CC(C)C1=CC=C(C=C1)CO Z56347221 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.3 CCC1=CC=C(C=C1)C(=O)O Z104478474 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.3 CN(C)C1=CC=C(C=C1)CO Z228585234 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.3 CNC1=CC=C(C=C1)C(=O)C Z1082871512 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.3 CNC1=CC=C(C=C1)C(=O)N Z744754554 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.3 CNC1=CC=C(C=C1)C(=O)O Z727574068 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.3 CNC1=CN=C(C=C1)[N+](=O)[O-] Z31222773 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.3 CNC1=NC=C(C=C1)[N+](=O)[O-] Z238434802 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.3 COC1=CC=C(C=C1)B(O)O Z336079536 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.3 COC1=CC=C(C=C1)C(=N)N Z228583094 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.3 COC1=CC=C(C=C1)C(=O)C Z53832960 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.3 COC1=CC=C(C=C1)C(=O)N Z33546492 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.3 COC1=CC=C(C=C1)C(=O)O Z56931884 [0,1,0,0,0,0|1,0,1]=3 189 B11R1.3 COC1=CC=C(C=C1)C(=S)N Z56964598 [0,1,0,0,0,0|2,1,0]=4 190 B11R1.3 COC1=CC=C(C=C1)C(C)O Z335245134 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.3 COC1=CC=C(C=C1)N(C)C Z57243982 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O Z360055358 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O Z360055354 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.3 COC1=CC=C(C=C1)[N+](=O)[O-] Z31131411 [0,1,0,0,0,0|0,0,0]=1 195 B11R1.3 COC1=NC=C(C=C1)C(=O)O Z135188086 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.3 CS(=O)C1=CC=C(C=C1)C=O Z1184878668 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.3 CS(=O)C1=CC=C(C=C1)CN Z1269182102 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.3 CSC1=CC=C(C=C1)C(=O)C Z57036277 [0,1,0,0,0,0|2,1,0]=4 199 B11R1.3 CSC1=CC=C(C=C1)C(=O)O Z57989066 [0,1,0,0,0,0|1,1,1]=4 200 B11R1.3 N#CC1=CC=C(C=C1)C(=O)N Z33546655 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.3 N#CC1=CC=C(C=C1)C(=O)O Z104476114 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.3 N#CC1=CC=C(C=C1)[N+](=O)[O-] Z57756571 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.3 NC(=O)C1=CC=C(C=C1)C=O Z316909626 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.3 NC(=O)C1=CC=C(C=C1)CCl Z154669306 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.3 NC(=O)C1=CC=C(C=C1)CO Z33545420 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.3 NCC1=CC=C(C=C1)C(=O)N Z57036329 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.3 NCC1=CC=C(C=C1)[N+](=O)[O-] Z1259155974 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.3 NNC1=CC=C(C=C1)C(=O)O Z56957167 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.3 O=C(O)C1=CC=C(C=C1)CBr Z55993105 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.3 O=C(O)C1=CC=C(C=C1)CCl Z111868896 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.3 O=C(O)C1=CC=C(C=C1)CO Z56917404 [0,1,0,0,0,0|1,0,1]=3 212 B11R1.3 O=C(O)C1=CC=C(C=C1)CS Z57989315 [0,1,0,0,0,0|1,1,1]=4 213 B11R1.3 O=C(O)C1=NC=C(C=C1)CO Z3015401233 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.3 O=CC1=CC=C(C=C1)C(=O)O Z104475878 [0,1,0,0,0,0|1,0,2]=4 215 B11R1.3 O=CC1=CC=C(C=C1)[N+](=O)[O-] Z57772464 [0,1,0,0,0,0|0,0,1]=2 216 B11R1.3 O=CC1=NC=C(C=C1)[N+](=O)[O-] Z1198172141 [0,1,0,0,0,0|1,0,1]=3 217 B11R1.3 O=[N+]([O-])C1=CC=C(C=C1)CBr Z56757346 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.3 O=[N+]([O-])C1=CC=C(C=C1)CCl Z56938009 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.3 OCC1=CC=C(C=C1)B(O)O Z1203162320 [0,1,0,0,0,0|1,0,2]=4 220 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O Z57127886 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.19 CC(C)(O)C1=CC=C(C=C1)O Z1198750150 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)F Z1255372425 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)N Z45415564 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O Z2218556278 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O Z2306780869 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.19 CS(=N)(=O)C1=CC=C(C=C1)N Z1262638032 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)Br Z432550092 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)Cl Z56757032 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)F Z57475486 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)N Z85926241 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)O Z147646800 [0,1,0,0,0,0|1,0,1]=3 232 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)F Z1198147270 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)N Z56851240 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)O Z104473374 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)Br Z45415551 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)Cl Z45415550 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)F Z45415567 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)I Z300170034 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)O Z360053740 [0,1,0,0,0,0|1,0,1]=3 240 B11R1.19 O=P(O)(O)C1=CC=C(C=C1)I Z1416158416 [0,1,0,0,0,0|1,1,1]=4 241 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)Br Z56823552 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)Cl Z104472128 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)F Z56940934 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)Br Z1416159100 [0,1,0,0,0,0|2,0,1]=4 245 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)Cl Z1198157369 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)F Z1198164091 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)I Z1269193258 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)O Z1513807665 [0,1,0,0,0,0|1,0,1]=3 249 B11R1.19 O=S(=O)(F)C1=CN=C(C=C1)O Z3327849368 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.19 O=S(=O)(F)C1=NC=C(C=C1)O Z3678887634 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.19 O=S(=O)(O)C1=CC=C(C=C1)O Z2583059497 [0,1,0,0,0,0|1,0,1]=3 252 B11R1.19 OC1=CC=C(C=C1)C(F)(F)F Z56347220 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)C Z1269191523 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)Cl Z1269244993 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)F Z1269159079 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)N Z1269218710 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)C Z104477440 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)F Z513735432 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)N Z1198175137 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)O Z1198169413 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Br Z1269168018 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl Z104475662 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F Z1201622912 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)N Z979493752 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br Z199532232 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)C Z606338894 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Cl Z335437578 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F Z56968900 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)N Z1198150660 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O Z1201626572 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)N Z1255447249 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)O Z1198158301 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br Z1037557930 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F Z385458772 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N Z1664347745 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)Br Z57206544 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F Z116821650 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)N Z57912417 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)O Z323032498 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Br Z57204180 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C Z104477078 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl Z1097117588 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F Z104510124 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I Z239685220 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)N Z57127001 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.21 CC1=C(C=C(C=C1)S(=O)[O-])C Z1455991568 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])C Z104488476 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])F Z992934732 [0,1,0,0,0,0|1,0,0]=2 294 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])I Z56924548 [0,1,0,0,0,0|1,0,0]=2 295 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])N Z56926522 [0,1,0,0,0,0|1,0,0]=2 296 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])O Z415740552 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)I Z1118973913 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)N Z239125318 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br Z1269154857 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl Z1201618086 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F Z959335402 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)I Z239685242 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N Z223458490 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O Z995149794 [0,1,0,0,0,0|1,0,1]=3 305 B11R1.21 CC1=C(C=CC(=C1)N(C)C)O Z4988450441 [0,1,0,0,0,0|2,0,1]=4 306 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z385459404 [0,1,0,0,0,0|1,0,0]=2 307 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])N Z56926519 [0,1,0,0,0,0|1,0,0]=2 308 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740536 [0,1,0,0,0,0|0,0,0]=1 309 B11R1.21 CC1=C(N=CC(=C1)[N+](=O)[O-])C Z1255467278 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.21 CC1=C(N=CC(=C1)[N+](=O)[O-])Cl Z991524294 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.21 CC1=C(N=CC(=C1)[N+](=O)[O-])O Z1442210025 [0,1,0,0,0,0|1,0,0]=2 312 B11R1.21 CC1=[N+](C=CC(=C1)[N+](=O)[O-])[O-] Z56756155 [0,1,0,0,0,0|1,0,1]=3 313 B11R1.21 CN1C=C(C=CC1=O)[N+](=O)[O-] Z54715870 [0,1,0,0,0,0|1,0,1]=3 314 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)F Z851822858 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)O Z1269119521 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.21 NC(=O)C1=CC(=C(C=C1)Cl)N Z239125304 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)F Z82670082 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)N Z316119774 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)Br Z394874930 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)F Z1127744306 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)Br Z317054104 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)F Z995047024 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)N Z424798268 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)O Z1126161217 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)F Z1255448698 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Br Z319214986 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Cl Z1082868852 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)F Z756936498 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)N Z104484514 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.21 NC1=C(C=C(C=C1)[N+](=O)[O-])Br Z104492192 [0,1,0,0,0,0|1,0,0]=2 334 B11R1.21 NC1=C(C=C(C=C1)[N+](=O)[O-])Cl Z57126995 [0,1,0,0,0,0|1,0,0]=2 335 B11R1.21 NC1=C(C=C(C=C1)[N+](=O)[O-])F Z381352378 [0,1,0,0,0,0|1,0,0]=2 336 B11R1.21 NC1=C(C=C(C=C1)[N+](=O)[O-])N Z104474480 [0,1,0,0,0,0|1,0,0]=2 337 B11R1.21 NC1=C(C=C(C=N1)[N+](=O)[O-])Br Z1267727489 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Br Z57127000 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Cl Z104478358 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)F Z283856672 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)I Z1079174176 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.21 NC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z57163404 [0,1,0,0,0,0|1,0,0]=2 343 B11R1.21 NC1=C(C=CC(=C1)[N+](=O)[O-])F Z57127390 [0,1,0,0,0,0|1,0,0]=2 344 B11R1.21 NC1=C(C=CC(=C1)[N+](=O)[O-])O Z56346992 [0,1,0,0,0,0|0,0,0]=1 345 B11R1.21 NC1=C(C=CC(=N1)C(=O)O)O Z1198313022 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.21 NC1=C(N=CC(=C1)[N+](=O)[O-])N Z1198277840 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)Cl Z1269111039 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)F Z756477072 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Br Z1269180540 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Cl Z104474098 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)F Z636292752 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)I Z239685218 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Br Z381356490 [0,1,0,0,0,0|2,0,1]=4 356 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Cl Z1203161796 [0,1,0,0,0,0|2,0,1]=4 357 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)F Z104341246 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)I Z1269207858 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Br Z382582728 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Cl Z1269153522 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)F Z1115194701 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)I Z1269131507 [0,1,0,0,0,0|2,0,1]=4 364 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Br Z57985393 [0,1,0,0,0,0|1,0,1]=3 366 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Cl Z104503564 [0,1,0,0,0,0|1,0,1]=3 367 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)F Z57073754 [0,1,0,0,0,0|1,0,1]=3 368 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [0,1,0,0,0,0|1,0,1]=3 369 B11R1.21 O=C(O)C1=CC(=C(C=C1)S)Br Z1269190145 [0,1,0,0,0,0|1,1,1]=4 370 B11R1.21 O=C(O)C1=CC(=C(N=C1)O)F Z1255436475 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.21 O=C(O)C1=CC(=O)N(C=C1)O Z3244880399 [0,1,0,0,0,0|2,0,1]=4 372 B11R1.21 O=C(O)C1=CC=C(C(=O)O1)O Z1262515745 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)Br Z852036266 [0,1,0,0,0,0|1,0,0]=2 374 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)Cl Z57127891 [0,1,0,0,0,0|1,0,0]=2 375 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)O Z57160128 [0,1,0,0,0,0|1,0,0]=2 376 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)F)Cl Z104473890 [0,1,0,0,0,0|1,0,0]=2 377 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)F)F Z362626586 [0,1,0,0,0,0|1,0,0]=2 378 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)I)Cl Z397593310 [0,1,0,0,0,0|1,0,0]=2 379 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)Br Z442212768 [0,1,0,0,0,0|0,0,0]=1 380 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)Cl Z99601186 [0,1,0,0,0,0|0,0,0]=1 381 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)F Z382708858 [0,1,0,0,0,0|0,0,0]=1 382 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)O Z1255450010 [0,1,0,0,0,0|0,0,0]=1 383 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)S)Cl Z1551929546 [0,1,0,0,0,0|0,1,0]=2 384 B11R1.21 O=[N+]([O-])C1=CC(=C(N=C1)O)Cl Z1198169261 [0,1,0,0,0,0|1,0,0]=2 385 B11R1.22 C#CC(=O)C1=CC=C(C=C1)Cl Z1266856320 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.22 C=CC(=O)C1=CC=C(C=C1)O Z1416178613 [0,1,0,0,0,0|2,0,0]=3 387 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [0,1,0,0,0,0|3,0,0]=4 389 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [0,1,0,0,0,0|3,0,0]=4 392 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [0,1,0,0,0,0|3,0,0]=4 393 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [0,1,0,0,0,0|2,0,1]=4 394 B11R1.22 CC1=CC=C(C=C1)C(=O)NO Z59182007 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [0,1,0,0,0,0|3,0,0]=4 398 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [0,1,0,0,0,0|2,0,1]=4 404 B11R1.22 CCS(=O)C1=CC=C(C=C1)F Z1154828228 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br Z30272262 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.22 CNC(=O)C1=CC=C(C=C1)C Z32016517 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.22 CNC(=O)C1=CC=C(C=C1)Cl Z32016366 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.22 CNC(=O)C1=CC=C(C=C1)I Z30272273 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.22 CNC(=O)C1=CC=C(C=C1)N Z56985799 [0,1,0,0,0,0|3,0,0]=4 410 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [0,1,0,0,0,0|3,0,0]=4 412 B11R1.22 COC(=O)C1=CC=C(C=C1)Br Z19682625 [0,1,0,0,0,0|2,0,1]=4 413 B11R1.22 COC(=O)C1=CC=C(C=C1)I Z19776689 [0,1,0,0,0,0|2,0,1]=4 414 B11R1.22 COC(=O)C1=CC=C(C=C1)N Z54178705 [0,1,0,0,0,0|2,0,1]=4 415 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [0,1,0,0,0,0|1,0,1]=3 416 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O Z156964722 [0,1,0,0,0,0|2,0,1]=4 417 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [0,1,0,0,0,0|3,0,0]=4 420 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [0,1,0,0,0,0|2,0,0]=3 421 B11R1.22 NNC(=O)C1=CC=C(C=C1)Br Z56899079 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.22 NNC(=O)C1=CC=C(C=C1)F Z56862389 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.22 NNC(=O)C1=CC=C(C=C1)N Z57199627 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br Z57708731 [0,1,0,0,0,0|3,0,0]=4 426 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Cl Z104484576 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.22 O=C(CBr)C1=CC=C(C=C1)F Z104495742 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br Z56886257 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Cl Z104477840 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.22 O=C(CCl)C1=CC=C(C=C1)F Z104478978 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.22 O=C(CCl)C1=CC=C(C=C1)I Z57046985 [0,1,0,0,0,0|3,0,0]=4 432 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl Z906206720 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.22 O=C(NO)C1=CC=C(C=C1)Br Z59181930 [0,1,0,0,0,0|2,0,1]=4 435 B11R1.22 O=C(NO)C1=CC=C(C=C1)Cl Z59181938 [0,1,0,0,0,0|2,0,1]=4 436 B11R1.22 O=C(NO)C1=CC=C(C=C1)I Z59181951 [0,1,0,0,0,0|2,0,1]=4 437 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Br Z1269163105 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)Br Z56886263 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)F Z1269134115 [0,1,0,0,0,0|3,0,0]=4 440 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)N Z906123248 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)O Z57790679 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.166 CC(=O)C1=C(C=C(C=C1)C)O Z169857138 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl Z104477446 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O Z1255487749 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Br Z1269135621 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)C Z1020765764 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Cl Z107334162 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)F Z57046231 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)O Z1080542132 [0,1,0,0,0,0|3,0,0]=4 450 B11R1.166 CC(=O)C1=C(C=C(C=C1)I)O Z1269204587 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)C Z1198307593 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl Z1206884651 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)C Z1255386683 [0,1,0,0,0,0|2,0,0]=3 454 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)Cl Z1222422341 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)F Z1123826135 [0,1,0,0,0,0|2,0,0]=3 456 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)O Z57101026 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)O Z443357522 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)O Z1203161814 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O Z732710370 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.166 CC1=C(C=CC(=C1)N)C(=O)N Z877632726 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.166 CC1=C(C=CC(=C1)N)C(=O)O Z877640950 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.166 CC1=C(C=CC(=C1)N)[N+](=O)[O-] Z415730040 [0,1,0,0,0,0|1,0,0]=2 463 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)N Z1255467737 [0,1,0,0,0,0|2,0,0]=3 464 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)O Z1255361025 [0,1,0,0,0,0|1,0,1]=3 465 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C Z104476618 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.166 CC1=C(C=CC(=C1)O)[N+](=O)[O-] Z85922875 [0,1,0,0,0,0|0,0,0]=1 467 B11R1.166 CC1=C(C=CC(=N1)Cl)[N+](=O)[O-] Z1255360809 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.166 CC1=C(C=CC(=N1)N)[N+](=O)[O-] Z1203162411 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.166 CC1=C(C=NC(=C1)Cl)[N+](=O)[O-] Z1255364706 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.166 CC1=C(C=NC(=C1)N)[N+](=O)[O-] Z1259273230 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.166 CC1=CC(=C(C=C1)C(=O)N)N Z1201619842 [0,1,0,0,0,0|3,0,0]=4 472 B11R1.166 CC1=CC(=C(C=C1)C(=O)N)O Z68591273 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Br Z1269191524 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C Z104478236 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Cl Z1741968837 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F Z732710382 [0,1,0,0,0,0|2,0,1]=4 477 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O Z104500502 [0,1,0,0,0,0|2,0,1]=4 478 B11R1.166 CC1=CC(=C(C=C1)[N+](=O)[O-])N Z1664380848 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.166 CC1=CC(=O)NC=C1[N+](=O)[O-] Z625801054 [0,1,0,0,0,0|1,0,1]=3 480 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])N Z1203162410 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])O Z1436472854 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.166 CS(=O)C1=C(C=C(C=C1)N)F Z1262251409 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.166 NC(=O)C1=C(C=C(C=C1)Br)Cl Z448248264 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.166 NC(=O)C1=C(C=C(C=C1)Br)I Z1083498168 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.166 NC(=O)C1=C(C=C(C=C1)Cl)F Z116821738 [0,1,0,0,0,0|3,0,0]=4 486 B11R1.166 NC(=O)C1=C(C=C(C=C1)Cl)N Z239125314 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.166 NC(=O)C1=C(C=C(C=C1)Cl)O Z68591606 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.166 NC(=O)C1=C(C=C(C=C1)F)Br Z101185864 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.166 NC(=O)C1=C(C=C(C=C1)F)Cl Z33546959 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.166 NC(=O)C1=C(C=C(C=C1)F)F Z33546764 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.166 NC(=O)C1=C(C=C(C=C1)F)N Z424996802 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.166 NC(=O)C1=C(C=C(C=C1)N)Cl Z239125316 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.166 NC(=O)C1=C(C=C(C=C1)N)F Z851815218 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.166 NC(=O)C1=C(C=C(C=C1)N)N Z756172834 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.166 NC1=C(C=CC(=C1)Br)C(=O)O Z431518646 [0,1,0,0,0,0|2,0,1]=4 496 B11R1.166 NC1=C(C=CC(=C1)Cl)C(=O)O Z104474094 [0,1,0,0,0,0|2,0,1]=4 497 B11R1.166 NC1=C(C=CC(=C1)Cl)[N+](=O)[O-] Z104475410 [0,1,0,0,0,0|1,0,0]=2 498 B11R1.166 NC1=C(C=CC(=C1)F)C(=O)O Z106939542 [0,1,0,0,0,0|2,0,1]=4 499 B11R1.166 NC1=C(C=CC(=C1)F)[N+](=O)[O-] Z600398356 [0,1,0,0,0,0|1,0,0]=2 500 B11R1.166 NC1=C(C=CC(=C1)I)C(=O)O Z1269152139 [0,1,0,0,0,0|2,0,1]=4 501 B11R1.166 NC1=C(C=CC(=N1)Cl)[N+](=O)[O-] Z211319392 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.166 NC1=C(C=NC(=N1)Cl)[N+](=O)[O-] Z317062700 [0,1,0,0,0,0|3,0,0]=4 503 B11R1.166 NC1=C(C=NC(=N1)S)[N+](=O)[O-] Z276572860 [0,1,0,0,0,0|2,1,0]=4 504 B11R1.166 NC1=C(C=NC(=O)N1)[N+](=O)[O-] Z1255445860 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.166 NC1=CC(=C(C=C1)C(=O)O)Br Z3185477282 [0,1,0,0,0,0|2,0,1]=4 506 B11R1.166 NC1=CC(=C(C=C1)C(=O)O)Cl Z734133022 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.166 NC1=CC(=C(C=C1)C(=O)O)F Z851819874 [0,1,0,0,0,0|2,0,1]=4 508 B11R1.166 NC1=CC(=C(C=C1)C(=O)O)I Z1020801338 [0,1,0,0,0,0|2,0,1]=4 509 B11R1.166 NC1=CC(=C(C=C1)C(=O)O)O Z90121065 [0,1,0,0,0,0|2,0,1]=4 510 B11R1.166 NC1=CC(=C(C=C1)[N+](=O)[O-])Cl Z1065885444 [0,1,0,0,0,0|1,0,0]=2 511 B11R1.166 NC1=NC(=C(C=C1)[N+](=O)[O-])N Z1198159794 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.166 O=C(O)C1=C(C=C(C=C1)Br)Br Z1259341990 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.166 O=C(O)C1=C(C=C(C=C1)Br)Cl Z448102192 [0,1,0,0,0,0|2,0,1]=4 514 B11R1.166 O=C(O)C1=C(C=C(C=C1)Br)F Z106938872 [0,1,0,0,0,0|2,0,1]=4 515 B11R1.166 O=C(O)C1=C(C=C(C=C1)Br)I Z607863674 [0,1,0,0,0,0|2,0,1]=4 516 B11R1.166 O=C(O)C1=C(C=C(C=C1)Br)O Z367679208 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.166 O=C(O)C1=C(C=C(C=C1)Cl)Br Z1269165449 [0,1,0,0,0,0|2,0,1]=4 518 B11R1.166 O=C(O)C1=C(C=C(C=C1)Cl)Cl Z57127531 [0,1,0,0,0,0|2,0,1]=4 519 B11R1.166 O=C(O)C1=C(C=C(C=C1)Cl)F Z104510482 [0,1,0,0,0,0|2,0,1]=4 520 B11R1.166 O=C(O)C1=C(C=C(C=C1)Cl)I Z239685216 [0,1,0,0,0,0|2,0,1]=4 521 B11R1.166 O=C(O)C1=C(C=C(C=C1)Cl)O Z57901799 [0,1,0,0,0,0|2,0,1]=4 522 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)Br Z104509888 [0,1,0,0,0,0|2,0,1]=4 523 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)Cl Z104480224 [0,1,0,0,0,0|2,0,1]=4 524 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)F Z104477622 [0,1,0,0,0,0|2,0,1]=4 525 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)I Z239685232 [0,1,0,0,0,0|2,0,1]=4 526 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)O Z854336256 [0,1,0,0,0,0|2,0,1]=4 527 B11R1.166 O=C(O)C1=C(C=C(C=C1)F)S Z228584386 [0,1,0,0,0,0|2,0,1]=4 528 B11R1.166 O=C(O)C1=C(C=C(C=C1)I)Cl Z1083220146 [0,1,0,0,0,0|2,0,1]=4 529 B11R1.166 O=C(O)C1=C(C=C(C=C1)I)O Z367679324 [0,1,0,0,0,0|2,0,1]=4 530 B11R1.166 O=C(O)C1=C(C=C(C=C1)O)F Z1201620915 [0,1,0,0,0,0|1,0,1]=3 531 B11R1.166 O=C(O)C1=C(C=C(C=C1)O)O Z104502292 [0,1,0,0,0,0|1,0,1]=3 532 B11R1.166 O=C(O)C1=C(C=C(C=C1)S)Cl Z1042085338 [0,1,0,0,0,0|1,1,1]=4 533 B11R1.166 O=C(O)C1=C(C=C(C=N1)O)F Z1255504709 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.166 O=C(O)C1=C(C=C(N=C1)O)O Z1198152580 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.166 O=C1NC=C(C(=O)N1)[N+](=O)[O-] Z274568144 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.166 O=[N+]([O-])C1=C(C=C(C=C1)Cl)O Z415740530 [0,1,0,0,0,0|1,0,0]=2 537 B11R1.166 O=[N+]([O-])C1=C(C=C(C=C1)F)O Z104476374 [0,1,0,0,0,0|1,0,0]=2 538 B11R1.166 O=[N+]([O-])C1=C(C=C(C=C1)O)Cl Z859818112 [0,1,0,0,0,0|0,0,0]=1 539 B11R1.166 O=[N+]([O-])C1=C(C=C(C=C1)O)F Z825783030 [0,1,0,0,0,0|0,0,0]=1 540 B11R1.166 O=[N+]([O-])C1=C(C=C(C=C1)O)O Z336080410 [0,1,0,0,0,0|0,0,0]=1 541 B11R1.166 O=[N+]([O-])C1=C(C=C(N=C1)Cl)Br Z1269120408 [0,1,0,0,0,0|2,0,0]=3 542 B9R1.35 CC1=CC(=CS1)S(=O)[O-] Z5209507990 [0,0,0,0,1,0|3,0,0]=4 543 B9R1.35 CC1=NC(=CN1)[N+](=O)[O-] Z1245636358 [0,0,0,0,1,0|3,0,0]=4 544 B9R1.35 CN1C=C(C=N1)[N+](=O)[O-] Z821315474 [0,0,0,0,1,0|3,0,0]=4 545 B9R1.35 NC1=NC=C(S1)[N+](=O)[O-] Z56786623 [0,0,0,0,1,0|3,0,0]=4 546 B9R1.35 NC1=NNC(=C1)[N+](=O)[O-] Z2768171949 [0,0,0,0,1,0|3,0,0]=4 547 B9R1.35 O=C(O)C1=CC(=CS1)O Z1157742699 [0,0,0,0,1,0|2,0,1]=4 548 B9R1.35 O=C1NC=C(S1)[N+](=O)[O-] Z3227132956 [0,0,0,0,1,0|2,0,1]=4 549 B9R1.35 O=[N+]([O-])C1=CC=C(S1)Br Z600427368 [0,0,0,0,1,0|2,0,0]=3 550 B9R1.35 O=[N+]([O-])C1=CC=C(S1)Cl Z759291646 [0,0,0,0,1,0|2,0,0]=3 551 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Br)/[O-] Z57107891 [0,0,0,0,0,1|2,0,0]=3 552 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Cl)/[O-] Z57107890 [0,0,0,0,0,1|2,0,0]=3 553 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,0,0,0,0,1|3,0,0]=4 554 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,0,0,0,0,1|3,0,0]=4 555 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,0,0,0,0,1|3,0,0]=4 556 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,0,0,0,0,1|3,0,0]=4 557 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,0,0,0,0,1|3,0,0]=4 558 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,0,0,0,0,1|3,0,0]=4 559 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,0,0,0,0,1|2,0,0]=3 560 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,0,0,0,0,1|2,1,0]=4 561 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,0,0,0,0,1|2,0,0]=3 562 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,0,0,0,0,1|3,0,0]=4 563 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,0,0,0,0,1|2,0,1]=4 564 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,0,0,0,0,1|3,0,0]=4 565 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,0,0,0,0,1|3,0,0]=4 566 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,0,0,0,0,1|3,0,0]=4 567 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,0,0,0,0,1|3,0,0]=4 568 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,0,0,0,0,1|3,0,0]=4 569 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,0,0,0,0,1|3,0,0]=4 570 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,0,0,0,0,1|3,0,0]=4 571 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,0,0,0,0,1|3,0,0]=4 572 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,0,0,0,0,1|3,0,0]=4 573 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,0,0,0,0,1|3,0,0]=4 574 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,0,0,0,0,1|2,0,1]=4 575 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,0,0,0,0,1|3,0,0]=4 576 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,0,0,0,0,1|2,0,1]=4 577 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,0,0,0,0,1|2,0,1]=4 578 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,0,0,0,0,1|2,0,1]=4 579 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|2,0,0]=4 581 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,1]=4 582 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 584 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|1,0,1]=4 587 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [2,0,0,0,0,0|2,0,0]=4 588 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [2,0,0,0,0,0|2,0,0]=4 589 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [2,0,0,0,0,0|2,0,0]=4 590 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|1,0,1]=4 591 B8R1.3 BrC1=CC=C(C=C1)Br Z104474572 [2,0,0,0,0,0|2,0,0]=4 592 B8R1.3 BrC1=CC=C(C=C1)I Z299596184 [2,0,0,0,0,0|2,0,0]=4 593 B8R1.3 CC1=CC=C(C=C1)C Z199056432 [2,0,0,0,0,0|2,0,0]=4 594 B8R1.3 CC1=CC=C(C=C1)Cl Z56924546 [2,0,0,0,0,0|2,0,0]=4 595 B8R1.3 CC1=CC=C(C=C1)F Z104473648 [2,0,0,0,0,0|2,0,0]=4 596 B8R1.3 CC1=CC=C(C=C1)N Z57127875 [2,0,0,0,0,0|1,0,1]=4 597 B8R1.3 CC1=CC=C(C=C1)O Z104473818 [2,0,0,0,0,0|1,0,0]=3 598 B8R1.3 CC1=CN=C(C=C1)O Z1255523405 [2,0,0,0,0,0|2,0,0]=4 599 B8R1.3 CC1=NC=C(C=C1)O Z838078132 [2,0,0,0,0,0|2,0,0]=4 600 B8R1.3 ClC1=CC=C(C=C1)Cl Z104476304 [2,0,0,0,0,0|2,0,0]=4 601 B8R1.3 NC1=CC=C(C=C1)Cl Z104472774 [2,0,0,0,0,0|1,0,1]=4 602 B8R1.3 NC1=CC=C(C=C1)F Z57127563 [2,0,0,0,0,0|1,0,1]=4 603 B8R1.3 NC1=CC=C(C=C1)I Z57127369 [2,0,0,0,0,0|1,0,1]=4 604 B8R1.3 NC1=CC=C(C=C1)N Z104472524 [2,0,0,0,0,0|1,0,1]=4 605 B8R1.3 NC1=CC=C(C=C1)O Z57127517 [2,0,0,0,0,0|0,0,1]=3 606 B8R1.3 NC1=CN=C(C=C1)O Z385458150 [2,0,0,0,0,0|1,0,1]=4 607 B8R1.3 O=C1C=CC(=CN1)Br Z271004874 [2,0,0,0,0,0|2,0,0]=4 608 B8R1.3 O=C1C=CC(=O)C=C1 Z104474802 [2,0,0,0,0,0|0,0,1]=3 609 B8R1.3 OC1=CC=C(C=C1)Br Z57127362 [2,0,0,0,0,0|1,0,0]=3 610 B8R1.3 OC1=CC=C(C=C1)Cl Z104473434 [2,0,0,0,0,0|1,0,0]=3 611 B8R1.3 OC1=CC=C(C=C1)I Z104496300 [2,0,0,0,0,0|1,0,0]=3 612 B8R1.3 OC1=CC=C(C=C1)O Z57127551 [2,0,0,0,0,0|0,0,1]=3 613 B8R1.3 OC1=CN=C(C=C1)Br Z1201622821 [2,0,0,0,0,0|2,0,0]=4 614 B8R1.3 OC1=CN=C(C=C1)I Z1269183606 [2,0,0,0,0,0|2,0,0]=4 615 B8R1.3 OC1=CN=C(C=C1)O Z1198152559 [2,0,0,0,0,0|1,0,1]=4 616 B8R1.3 OC1=NC=C(C=C1)Cl Z2235409237 [2,0,0,0,0,0|2,0,0]=4 617 B8R1.3 OC1=NC=C(C=C1)F Z594267896 [2,0,0,0,0,0|2,0,0]=4 618 B8R1.3 OC1=NC=C(C=C1)I Z1269227573 [2,0,0,0,0,0|2,0,0]=4 619 B8R1.3 SC1=CC=C(C=C1)Cl Z57834219 [2,0,0,0,0,0|1,1,0]=4 620 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,1,0,0,0,0|0,0,2]=4 625 B10R1.1 O=C=NC1=CC=C(C=C1)Br Z316172584 [1,1,0,0,0,0|1,0,1]=4 626 B10R1.1 O=C=NC1=CC=C(C=C1)Cl Z104472166 [1,1,0,0,0,0|1,0,1]=4 627 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,1,0,0,0,0|0,0,1]=3 631 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.3 C#CC1=CC=C(C=C1)C=O Z1203159515 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.3 C#CC1=CC=C(C=C1)CO Z1255489573 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.3 C=CC1=CC=C(C=C1)C=O Z1198150327 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.3 CCC1=CC=C(C=C1)C=O Z104477712 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.3 CNC1=CC=C(C=C1)C=O Z1203730934 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.3 CNC1=CC=C(C=C1)OC Z335282780 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.3 COC1=CC=C(C=C1)C#N Z53834531 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.3 COC1=CC=C(C=C1)C=O Z53833125 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.3 COC1=CC=C(C=C1)CO Z54603098 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.3 COC1=CC=C(C=C1)CS Z1255360358 [1,1,0,0,0,0|1,1,0]=4 642 B10R1.3 COC1=CC=C(C=C1)OC Z53833835 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.3 COC1=CN=C(C=C1)C=O Z1198176556 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.3 COC1=NC=C(C=C1)C=O Z1255356725 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.3 CSC1=CC=C(C=C1)C=O Z104478194 [1,1,0,0,0,0|1,1,0]=4 646 B10R1.3 N#CC1=CC=C(C=C1)C=O Z104478052 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.3 N#CC1=CC=C(C=C1)CO Z335244916 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.3 NCC1=CC=C(C=C1)C=O Z2418414207 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.3 NCC1=CC=C(C=C1)CO Z385458374 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.3 O=CC1=CC=C(C=C1)C=O Z104478582 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.3 O=CC1=CC=C(C=C1)CBr Z1201624503 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.3 O=CC1=CC=C(C=C1)CCl Z1198151895 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.3 O=CC1=CC=C(C=C1)CF Z1255498899 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.3 O=CC1=CC=C(C=C1)CO Z1255384176 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.25 CC1=C(C=CC(=C1)Br)C=O Z1079442722 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O Z1201621733 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.25 CC1=C(C=CC(=C1)F)C=O Z853084730 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.25 CC1=C(C=CC(=C1)O)C#N Z1255452759 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.25 CC1=C(C=CC(=C1)O)C=O Z1161074806 [1,1,0,0,0,0|1,0,0]=3 660 B10R1.25 CC1=C(C=NC(=C1)O)C=O Z1486001188 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.25 CC1=CC(=C(C=C1)C=O)Br Z1255427913 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.25 CC1=CC(=C(C=C1)C=O)C Z104479608 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl Z1198280103 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.25 CC1=CC(=C(C=C1)C=O)F Z732814038 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.25 CC1=CC(=C(C=C1)C=O)N Z1198276968 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.25 CC1=CC(=C(C=C1)C=O)O Z1203159482 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.25 CCC1=C(C=C(C=C1)O)O Z104499414 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.25 CNC1=C(C=C(C=C1)O)C Z2740415969 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.25 COC1=C(C=C(C=C1)O)F Z415739536 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.25 COC1=C(C=C(C=C1)O)I Z1269222013 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.25 CSC1=C(C=C(C=C1)O)Br Z1269227695 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.25 CSC1=C(C=C(C=C1)O)C Z277164168 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.25 N#CC1=C(C=C(C=C1)O)F Z1157728598 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.25 N#CC1=C(C=C(C=C1)O)O Z1255361029 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 NC1=CC(=C(C=C1)C=O)Cl Z1206884716 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.25 NCC1=C(C=C(C=C1)O)F Z3244923137 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.25 NCC1=C(C=C(C=C1)O)O Z2350903951 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 O=CC1=C(C=C(C=C1)Br)Br Z1269133882 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.25 O=CC1=C(C=C(C=C1)Br)Cl Z1079442724 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 O=CC1=C(C=C(C=C1)Br)F Z104486154 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.25 O=CC1=C(C=C(C=C1)Br)I Z1269178376 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.25 O=CC1=C(C=C(C=C1)Br)O Z405051414 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Br Z1269165294 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Cl Z57127525 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.25 O=CC1=C(C=C(C=C1)Cl)F Z1079442614 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.25 O=CC1=C(C=C(C=C1)Cl)O Z1201623478 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.25 O=CC1=C(C=C(C=C1)F)Br Z1079442442 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.25 O=CC1=C(C=C(C=C1)F)Cl Z1079442562 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.25 O=CC1=C(C=C(C=C1)F)F Z104495222 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.25 O=CC1=C(C=C(C=C1)F)I Z1269211883 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.25 O=CC1=C(C=C(C=C1)F)O Z1201622454 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 O=CC1=C(C=C(C=C1)I)Cl Z1269135461 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 O=CC1=C(C=C(C=C1)O)Br Z622749802 [1,1,0,0,0,0|1,0,0]=3 694 B10R1.25 O=CC1=C(C=C(C=C1)O)Cl Z1255419357 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.25 O=CC1=C(C=C(C=C1)O)F Z1201623850 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.25 O=CC1=C(C=C(C=C1)O)O Z104497974 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.176 CC1=C(C=C(C=C1)C=O)Br Z1198165094 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.176 CC1=C(C=C(C=C1)C=O)C Z147641440 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.176 CC1=C(C=C(C=C1)C=O)Cl Z1097119562 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.176 CC1=C(C=C(C=C1)C=O)F Z1079442530 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.176 CC1=C(C=C(C=C1)C=O)O Z1198157218 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.176 CC1=C(C=CC(=C1)C#N)O Z606249182 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.176 CC1=C(C=CC(=C1)C=O)Br Z1198175071 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.176 CC1=C(C=CC(=C1)C=O)Cl Z1201621734 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.176 CC1=C(C=CC(=C1)C=O)F Z732814060 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.176 CC1=C(C=CC(=C1)C=O)I Z1269181559 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.176 CC1=C(C=CC(=C1)C=O)O Z1082846778 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.176 CC1=C(C=CC(=N1)C=O)O Z1255405992 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.176 CC1=C(N=CC(=C1)C=O)O Z1415926172 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.176 CCC1=CC(=C(C=C1)O)N Z1318147478 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.176 COC1=CC(=C(C=C1)O)N Z57727878 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.176 N#CC1=CC(=C(C=C1)O)Cl Z99599532 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.176 N#CC1=CC(=C(C=C1)O)I Z1269175329 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.176 N#CC1=CC(=C(C=C1)O)N Z425853908 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.176 NC1=C(C=C(C=C1)C=O)Cl Z1198314265 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.176 NCC1=CC(=C(C=C1)O)Br Z1436472846 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.176 NCC1=CC(=C(C=C1)O)Cl Z2757555437 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.176 NCC1=CC(=C(C=C1)O)F Z1250080941 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.176 NCC1=CC(=C(C=C1)O)O Z1272096628 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.176 O=CC1=CC(=C(C=C1)Br)Br Z1269188996 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.176 O=CC1=CC(=C(C=C1)Br)Cl Z1269162864 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.176 O=CC1=CC(=C(C=C1)Br)F Z1079442824 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.176 O=CC1=CC(=C(C=C1)Cl)Br Z1269163997 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.176 O=CC1=CC(=C(C=C1)Cl)Cl Z57887872 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.176 O=CC1=CC(=C(C=C1)Cl)F Z838969200 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.176 O=CC1=CC(=C(C=C1)Cl)O Z1255452805 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.176 O=CC1=CC(=C(C=C1)F)Br Z104489526 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.176 O=CC1=CC(=C(C=C1)F)Cl Z586248502 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.176 O=CC1=CC(=C(C=C1)F)F Z104477800 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.176 O=CC1=CC(=C(C=C1)F)I Z1269142176 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.176 O=CC1=CC(=C(C=C1)O)Br Z56960236 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.176 O=CC1=CC(=C(C=C1)O)Cl Z57313902 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.176 O=CC1=CC(=C(C=C1)O)F Z385458796 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.176 O=CC1=CC(=C(C=C1)O)O Z56957508 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.176 O=CC1=CC(=C(N=C1)O)Br Z1269204264 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.176 O=CC1=NC(=C(C=C1)O)O Z3243070108 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.176 OCC1=CC(=C(C=C1)O)Cl Z839172284 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.176 OCC1=CC(=C(C=C1)O)F Z385458838 [1,1,0,0,0,0|1,0,1]=4 741 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [1,1,0,0,0,0|1,0,1]=4 746 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 Z45415554 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 Z1255364683 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [1,1,0,0,0,0|1,0,1]=4 760 B10R1.61 CC1=C(C=CC=C1)[N+](=O)[O-] Z104473652 [1,1,0,0,0,0|0,0,0]=2 761 B10R1.61 CS(=O)C1=C(C=CC=C1)N Z609980396 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.61 NC1=C(C=CC=C1)[N+](=O)[O-] Z56924541 [1,1,0,0,0,0|0,0,0]=2 768 B10R1.61 NC1=C(C=NC=C1)[N+](=O)[O-] Z57160191 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.61 NC1=C(N=CC=C1)[N+](=O)[O-] Z1201618037 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [1,1,0,0,0,0|1,0,1]=4 771 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [1,1,0,0,0,0|1,0,1]=4 772 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [1,1,0,0,0,0|1,0,1]=4 773 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [1,1,0,0,0,0|1,0,1]=4 774 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [1,1,0,0,0,0|1,0,1]=4 775 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.61 O=C1NC=CC=C1[N+](=O)[O-] Z875018892 [1,1,0,0,0,0|1,0,0]=3 777 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)Cl Z104473258 [1,1,0,0,0,0|0,0,0]=2 778 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)I Z56926515 [1,1,0,0,0,0|0,0,0]=2 779 B10R1.61 O=[N+]([O-])C1=C(C=CC=N1)O Z56921159 [1,1,0,0,0,0|1,0,0]=3 780 B10R1.61 O=[N+]([O-])C1=C(C=CN=C1)Cl Z359373116 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.61 O=[N+]([O-])C1=C(C=CN=C1)O Z56759026 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] Z104508722 [1,1,0,0,0,0|0,0,0]=2 789 B10R1.113 CC1=CC(=NC=C1)[N+](=O)[O-] Z1198164196 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,1,0,0,0,0|1,0,1]=4 798 B10R1.113 NC1=CC(=CC=C1)[N+](=O)[O-] Z56924547 [1,1,0,0,0,0|0,0,0]=2 799 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,1,0,0,0,0|1,0,1]=4 800 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,1,0,0,0,0|1,0,1]=4 801 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,1,0,0,0,0|1,0,1]=4 802 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,1,0,0,0,0|1,0,1]=4 803 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,1,0,0,0,0|1,0,1]=4 804 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,1,0,0,0,0|1,0,1]=4 805 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,1,0,0,0,0|0,0,0]=2 806 B10R1.31 N#CC1=CC(=CN1)[N+](=O)[O-] Z3227127839 [0,1,0,0,1,0|2,0,0]=4 807 B10R1.31 N#CC1=CC=C(N1)[N+](=O)[O-] Z1201626443 [0,1,0,0,1,0|2,0,0]=4 808 B10R1.31 N#CC1=CC=C(O1)[N+](=O)[O-] Z381355302 [0,1,0,0,1,0|2,0,0]=4 809 B10R1.31 NCC1=CC=C(O1)[N+](=O)[O-] Z1262327531 [0,1,0,0,1,0|2,0,0]=4 810 B10R1.31 O=CC1=CC(=CO1)[N+](=O)[O-] Z1216836202 [0,1,0,0,1,0|1,0,1]=4 811 B10R1.31 O=CC1=CC=C(O1)[N+](=O)[O-] Z56836979 [0,1,0,0,1,0|1,0,1]=4 812 B10R1.31 O=CC1=CC=C(S1)[N+](=O)[O-] Z1255485293 [0,1,0,0,1,0|1,0,1]=4 813 B10R1.31 O=CC1=CSC(=C1)[N+](=O)[O-] Z447815800 [0,1,0,0,1,0|1,0,1]=4 814 B10R1.58 CC1=C(SC(=C1)[N+](=O)[O-])Br Z600615398 [0,1,0,0,1,0|2,0,0]=4 815 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,1,0,0,0,1|2,0,0]=4 816 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,1,0,0,0,1|2,0,0]=4 817 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,1,0,0,0,1|1,0,1]=4 818 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,1,0,0,0,1|2,0,0]=4 819 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,1,0,0,0,1|2,0,0]=4 820 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,1,0,0,0,1|2,0,0]=4 821 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,1,0,0,0,1|2,0,0]=4 822 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,1,0,0,0,1|2,0,0]=4 823 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,1,0,0,0,1|1,0,1]=4 824 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,1,0,0,0,1|1,0,1]=4 825 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,1,0,0,0,1|1,0,1]=4 826 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,1,0,0,0,1|1,0,1]=4 827 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,1,0,0,0,1|2,0,0]=4 828 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,1,0,0,0,1|2,0,0]=4 829 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,1,0,0,0,1|1,0,1]=4 830 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,1,0,0,0,1|1,0,1]=4 831 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [0,1,0,0,0,1|1,0,1]=4 832 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,1,0,0,0,1|2,0,0]=4 833 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,1,0,0,0,1|2,0,0]=4 834 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,1,0,0,0,1|1,0,1]=4 835 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,1,0,0,0,1|2,0,0]=4 836 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,1,0,0,0,1|1,0,1]=4 837 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,1,0,0,0,1|2,0,0]=4 838 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)O Z45652935 [0,1,0,0,0,1|1,0,1]=4 839 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)O Z335810542 [0,1,0,0,0,1|1,0,1]=4 840 B12R1.233 C/[N+](=C/C1=C(C=C(C=C1)Cl)Cl)/[O-] Z540726530 [0,1,0,0,0,1|2,0,0]=4 841 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,1,0,0,0,1|1,0,1]=4 842 B12R1.5 CNC(=O)C1=CC=C(C=C1)OC Z32016396 [0,2,0,0,0,0|2,0,0]=4 843 B12R1.5 COC(=O)C1=CC=C(C=C1)CO Z25262776 [0,2,0,0,0,0|1,0,1]=4 844 B12R1.5 COC1=CC=C(C=C1)C(=O)CCl Z56945957 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.5 COC1=CC=C(C=C1)C(=O)CO Z228585822 [0,2,0,0,0,0|1,0,1]=4 846 B12R1.5 COC1=CC=C(C=C1)C(=O)NN Z57199662 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.5 COC1=CC=C(C=C1)C(=O)NO Z59181957 [0,2,0,0,0,0|1,0,1]=4 848 B12R1.5 COC1=CC=C(C=C1)C(C)C=O Z1255380175 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.5 COC1=CC=C(C=C1)[C@H](C)C=O Z1511751525 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.6 COC1=CC=C(C=C1)S(=O)(=O)C Z196125820 [0,2,0,0,0,0|1,0,1]=4 851 B12R1.6 COC1=CC=C(C=C1)S(=O)(=O)Cl Z56860355 [0,2,0,0,0,0|1,0,1]=4 852 B12R1.6 COC1=CC=C(C=C1)S(=O)(=O)N Z45415561 [0,2,0,0,0,0|1,0,1]=4 853 B12R1.6 NS(=O)(=O)C1=CC=C(C=C1)CO Z1216814349 [0,2,0,0,0,0|1,0,1]=4 854 B12R1.6 O=CC1=CC=C(C=C1)S(=O)(=O)[O-] Z4685749593 [0,2,0,0,0,0|1,0,1]=4 855 B12R1.6 O=S(=O)([O-])C1=CC=C(C=C1)CO Z3035709916 [0,2,0,0,0,0|1,0,0]=3 856 B12R1.48 CC1=C(C=CC(=C1)[N+](=O)[O-])C#N Z1212719947 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.48 CC1=C(C=CC(=C1)[N+](=O)[O-])C=O Z1255493556 [0,2,0,0,0,0|0,0,1]=3 858 B12R1.48 CCC1=C(C=C(C=C1)[N+](=O)[O-])O Z3247263630 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.48 CNC1=C(C=C(C=C1)[N+](=O)[O-])N Z425800964 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.48 CNC1=C(C=C(C=N1)[N+](=O)[O-])Br Z1331905615 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)Br Z57042009 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)C Z415732058 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)Cl Z331027654 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)F Z85921976 [0,2,0,0,0,0|2,0,0]=4 865 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)O Z1255365043 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)Br Z101186024 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)F Z87615059 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)N Z239125322 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)Br Z57663652 [0,2,0,0,0,0|1,0,1]=4 870 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)Cl Z57790676 [0,2,0,0,0,0|1,0,1]=4 871 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)F Z57169536 [0,2,0,0,0,0|1,0,1]=4 872 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)I Z57200689 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)N Z274783176 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)O Z381356676 [0,2,0,0,0,0|1,0,1]=4 875 B12R1.48 COC1=C(C=C(C=C1)[N+](=O)[O-])N Z56782014 [0,2,0,0,0,0|0,0,0]=2 876 B12R1.48 NC1=C(C=CC(=C1)[N+](=O)[O-])C=O Z1198219348 [0,2,0,0,0,0|0,0,1]=3 877 B12R1.48 NCC1=C(C=C(C=C1)[N+](=O)[O-])Br Z489665910 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.48 NCC1=C(C=C(C=C1)[N+](=O)[O-])N Z3325116775 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.48 NCC1=C(C=C(C=C1)[N+](=O)[O-])O Z4261906319 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.48 O=C(O)C1=CC(=C(C=C1)CO)Cl Z1551918094 [0,2,0,0,0,0|1,0,1]=4 881 B12R1.48 O=C(O)C1=CC(=C(C=C1)CO)F Z1080722404 [0,2,0,0,0,0|1,0,1]=4 882 B12R1.48 O=CC1=C(C=C(C=C1)[N+](=O)[O-])Cl Z1184908013 [0,2,0,0,0,0|0,0,1]=3 883 B12R1.48 O=CC1=C(C=C(C=C1)[N+](=O)[O-])F Z1184908014 [0,2,0,0,0,0|0,0,1]=3 884 B12R1.48 O=CC1=C(C=C(C=C1)[N+](=O)[O-])O Z596250220 [0,2,0,0,0,0|0,0,1]=3 885 B12R1.48 O=CC1=C(C=C(C=N1)[N+](=O)[O-])F Z1278924516 [0,2,0,0,0,0|1,0,1]=4 886 B12R1.113 CCOC1=CC=C(C=C1)C(=O)C Z53832961 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.113 CCOC1=CC=C(C=C1)C(=O)N Z33546681 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.113 CCOC1=CC=C(C=C1)C(=O)O Z56759338 [0,2,0,0,0,0|1,0,1]=4 889 B12R1.113 CCOC1=CC=C(C=C1)S(=O)[O-] Z2111525259 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.113 CCOC1=NC=C(C=C1)[N+](=O)[O-] Z1255373009 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.113 CNCC1=CC=C(C=C1)[N+](=O)[O-] Z102766816 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.113 COCC1=CC=C(C=C1)C(=O)N Z52214428 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.113 COCC1=CC=C(C=C1)C(=O)O Z57981093 [0,2,0,0,0,0|1,0,1]=4 894 B12R1.113 N#CCC1=CC=C(C=C1)[N+](=O)[O-] Z57160210 [0,2,0,0,0,0|1,0,0]=3 895 B12R1.113 NNCC1=CC=C(C=C1)[N+](=O)[O-] Z451452416 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.113 O=C(O)C1=CC=C(C=C1)/C=N/O Z49568495 [0,2,0,0,0,0|1,0,1]=4 897 B12R1.113 O=C(O)C1=CC=C(C=C1)CCO Z1198159608 [0,2,0,0,0,0|1,0,1]=4 898 B12R1.113 O=C=NC1=CC=C(C=C1)[N+](=O)[O-] Z104475412 [0,2,0,0,0,0|0,0,1]=3 899 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)/C=C/Br Z1269168638 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)/C=N/O Z49568323 [0,2,0,0,0,0|0,0,0]=2 901 B12R1.256 CC(=O)C1=CC=C(C=C1)B(O)O Z1203161683 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)O Z335574216 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.256 CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] Z104473102 [0,2,0,0,0,0|0,0,1]=3 904 B12R1.256 CC(O)C1=CC=C(C=C1)C(=O)O Z1198155605 [0,2,0,0,0,0|1,0,1]=4 905 B12R1.256 CC(O)C1=CC=C(C=C1)[N+](=O)[O-] Z228586132 [0,2,0,0,0,0|0,0,0]=2 906 B12R1.256 CN(C)C1=NC=C(C=C1)[N+](=O)[O-] Z57727175 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.256 CS(=O)C1=CC=C(C=C1)C(=O)O Z119989874 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.256 N=C(N)C1=CC=C(C=C1)[N+](=O)[O-] Z381061448 [0,2,0,0,0,0|1,0,0]=3 909 B12R1.256 NC(=O)C1=CC=C(C=C1)B(O)O Z1171974289 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.256 NC(=O)C1=CC=C(C=C1)C(=O)O Z147646808 [0,2,0,0,0,0|2,0,0]=4 911 B12R1.256 O=C(O)C1=CC=C(C=C1)B(O)O Z285136920 [0,2,0,0,0,0|1,0,1]=4 912 B12R1.256 O=C(O)C1=CC=C(C=C1)C(=O)O Z57127536 [0,2,0,0,0,0|1,0,1]=4 913 B12R1.256 O=C(O)C1=CC=C(C=C1)[N+](=O)[O-] Z57127484 [0,2,0,0,0,0|0,0,0]=2 914 B12R1.256 O=[N+]([O-])C1=CC=C(C=C1)B(O)O Z838078136 [0,2,0,0,0,0|0,0,0]=2 915 B12R1.256 O=[N+]([O-])C1=CC=C(C=C1)C(F)F Z1255444859 [0,2,0,0,0,0|1,0,0]=3 916 B12R1.256 O=[N+]([O-])C1=CC=C(C=C1)S(=O)O Z56755568 [0,2,0,0,0,0|0,0,0]=2 917 B12R1.256 O=[N+]([O-])C1=NC=C(C=C1)B(O)O Z1255438204 [0,2,0,0,0,0|1,0,0]=3 918 B12R1.452 CC1=C(C=CC(=C1)C=O)[N+](=O)[O-] Z1255420040 [0,2,0,0,0,0|0,0,1]=3 919 B12R1.452 CC1=C(C=CC(=C1)CN)[N+](=O)[O-] Z3241258173 [0,2,0,0,0,0|1,0,0]=3 920 B12R1.452 CC1=C(C=CC(=C1)CO)[N+](=O)[O-] Z1255386715 [0,2,0,0,0,0|0,0,0]=2 921 B12R1.452 CC1=C(C=CC(=N1)CO)[N+](=O)[O-] Z1198279309 [0,2,0,0,0,0|1,0,0]=3 922 B12R1.452 CNC1=CC(=C(C=C1)[N+](=O)[O-])C Z419009538 [0,2,0,0,0,0|1,0,0]=3 923 B12R1.452 CNC1=CC(=C(C=C1)[N+](=O)[O-])N Z3244377547 [0,2,0,0,0,0|1,0,0]=3 924 B12R1.452 COC1=CC(=C(C=C1)C(=O)C)Br Z454080406 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.452 COC1=CC(=C(C=C1)C(=O)C)C Z285137066 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.452 COC1=CC(=C(C=C1)C(=O)C)N Z1198165201 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.452 COC1=CC(=C(C=C1)C(=O)C)O Z57101020 [0,2,0,0,0,0|2,0,0]=4 928 B12R1.452 COC1=CC(=C(C=C1)C(=O)N)O Z57032591 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)Br Z454080610 [0,2,0,0,0,0|1,0,1]=4 930 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)Cl Z431962480 [0,2,0,0,0,0|1,0,1]=4 931 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)F Z89264974 [0,2,0,0,0,0|1,0,1]=4 932 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)I Z1269201449 [0,2,0,0,0,0|1,0,1]=4 933 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)N Z367452116 [0,2,0,0,0,0|1,0,1]=4 934 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)O Z104499836 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.452 COC1=CC(=C(C=C1)[N+](=O)[O-])Br Z425364656 [0,2,0,0,0,0|0,0,0]=2 936 B12R1.452 COC1=CC(=C(C=C1)[N+](=O)[O-])C Z208835124 [0,2,0,0,0,0|0,0,0]=2 937 B12R1.452 COC1=CC(=C(C=C1)[N+](=O)[O-])N Z111691250 [0,2,0,0,0,0|0,0,0]=2 938 B12R1.452 COC1=CC(=C(C=C1)[N+](=O)[O-])O Z1079458544 [0,2,0,0,0,0|0,0,0]=2 939 B12R1.452 COC1=NC(=C(C=C1)[N+](=O)[O-])C Z1198161540 [0,2,0,0,0,0|1,0,0]=3 940 B12R1.452 COC1=NC(=C(C=C1)[N+](=O)[O-])N Z1255419867 [0,2,0,0,0,0|1,0,0]=3 941 B12R1.452 O=C(O)C1=C(C=C(C=C1)CO)F Z1255383867 [0,2,0,0,0,0|1,0,1]=4 942 B12R1.452 O=CC1=CC(=C(C=C1)[N+](=O)[O-])Cl Z1167044504 [0,2,0,0,0,0|0,0,1]=3 943 B12R1.452 O=CC1=CC(=C(C=C1)[N+](=O)[O-])F Z1201620724 [0,2,0,0,0,0|0,0,1]=3 944 B12R1.452 O=CC1=CC(=C(C=C1)[N+](=O)[O-])O Z959278078 [0,2,0,0,0,0|0,0,1]=3 945 B12R1.452 O=CC1=NC(=C(C=C1)[N+](=O)[O-])Br Z2310177209 [0,2,0,0,0,0|1,0,1]=4 946 B12R1.452 O=[N+]([O-])C1=C(C=C(C=C1)CO)O Z959305098 [0,2,0,0,0,0|0,0,0]=2 947 B12R1.9 CNS(=O)(=O)C1=CC=C(C=C1)O Z381036150 [0,2,0,0,0,0|1,0,1]=4 948 B12R1.23 CC1=C(C=C(C=C1)S(=O)(=O)[O-])C Z2740003284 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.23 CC1=C(C=CC(=C1)S(=O)(=O)C)O Z1486003588 [0,2,0,0,0,0|1,0,1]=4 950 B12R1.23 CS(=O)(=O)C1=CC(=C(C=C1)O)N Z57187730 [0,2,0,0,0,0|1,0,1]=4 951 B12R1.23 O=S(=O)(F)C1=CC(=C(C=C1)O)Br Z3379618871 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.126 CC1=C(C=CC(=C1)O)S(=O)(=O)C Z1278926303 [0,2,0,0,0,0|1,0,1]=4 953 B12R1.126 CC1=C(C=CC(=C1)O)S(=O)(=O)N Z1255501255 [0,2,0,0,0,0|1,0,1]=4 954 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)C#N Z1198160291 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)CCl Z56896221 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.56 CC1=C(C=C(C=C1)[N+](=O)[O-])C#N Z104495426 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.56 CC1=C(C=C(C=C1)[N+](=O)[O-])C=O Z1198163365 [0,2,0,0,0,0|1,0,0]=3 958 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)O Z1255420244 [0,2,0,0,0,0|1,0,1]=4 959 B12R1.56 CNC1=C(C=CC(=C1)[N+](=O)[O-])N Z1198234411 [0,2,0,0,0,0|1,0,0]=3 960 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O Z381356666 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])I Z406674790 [0,2,0,0,0,0|1,0,0]=3 963 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])N Z104477890 [0,2,0,0,0,0|1,0,0]=3 964 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740558 [0,2,0,0,0,0|0,0,0]=2 965 B12R1.56 COC1=CC(=CNC1=O)[N+](=O)[O-] Z2678251421 [0,2,0,0,0,0|1,0,1]=4 966 B12R1.56 N#CC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z57900337 [0,2,0,0,0,0|1,0,0]=3 967 B12R1.56 N#CC1=C(C=CC(=C1)[N+](=O)[O-])N Z57902192 [0,2,0,0,0,0|1,0,0]=3 968 B12R1.56 N#CC1=C(C=CC(=C1)[N+](=O)[O-])O Z362770844 [0,2,0,0,0,0|0,0,0]=2 969 B12R1.56 N#CC1=C(N=CC(=C1)[N+](=O)[O-])Cl Z104378228 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.56 N#CC1=CC(=CNC1=O)[N+](=O)[O-] Z94599218 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.56 NC1=C(C=C(C=C1)[N+](=O)[O-])C=O Z1198233260 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.56 NC1=C(C=C(C=C1)[N+](=O)[O-])CO Z960446264 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.56 NCC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z2065616412 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.56 NCC1=C(C=CC(=C1)[N+](=O)[O-])O Z56985679 [0,2,0,0,0,0|0,0,0]=2 975 B12R1.56 O=C(O)C1=CC(=C(C=C1)O)CO Z1262519174 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)O Z1255434815 [0,2,0,0,0,0|1,0,1]=4 977 B12R1.56 O=CC1=C(C=CC(=C1)[N+](=O)[O-])Br Z1269137725 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.56 O=CC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z104484824 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.56 O=CC1=C(C=CC(=C1)[N+](=O)[O-])F Z1203159370 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.56 O=CC1=C(C=CC(=C1)[N+](=O)[O-])O Z57160172 [0,2,0,0,0,0|0,0,0]=2 981 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)O)O Z274502124 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.232 CC1=C(C=C(C(=C1)Cl)Cl)[N+](=O)[O-] Z279593844 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.232 CC1=C(C=C(C(=C1)Cl)[N+](=O)[O-])N Z1198147269 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.232 CC1=C(C=C(C(=C1)Cl)[N+](=O)[O-])O Z1209414526 [0,2,0,0,0,0|1,0,0]=3 985 B12R1.232 CC1=C(C=C(C(=C1)N)[N+](=O)[O-])C Z104477752 [0,2,0,0,0,0|1,0,0]=3 986 B12R1.232 CC1=C(C=C(C(=C1)O)O)C(=O)O Z1255427529 [0,2,0,0,0,0|1,0,1]=4 987 B12R1.232 CC1=CC(=C(C=C1[N+](=O)[O-])C)N Z1201617498 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.232 CC1=CC(=C(C=C1[N+](=O)[O-])C)O Z235351527 [0,2,0,0,0,0|0,0,0]=2 989 B12R1.232 CC1=CC(=C(C=C1[N+](=O)[O-])N)C Z56785269 [0,2,0,0,0,0|1,0,0]=3 990 B12R1.232 NC1=C(C=C(C(=C1)F)F)[N+](=O)[O-] Z235347007 [0,2,0,0,0,0|1,0,0]=3 991 B12R1.232 NC1=C(C=C(C(=C1)[N+](=O)[O-])F)F Z235344777 [0,2,0,0,0,0|1,0,0]=3 992 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)O)F Z1939443092 [0,2,0,0,0,0|1,0,1]=4 993 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)F Z1255468561 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)N Z2177031047 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)Br Z111782420 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)Cl Z25120254 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)F Z1198152178 [0,2,0,0,0,0|1,0,1]=4 998 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)N Z802838774 [0,2,0,0,0,0|1,0,1]=4 999 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)O)O Z56912624 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.893 CC(=O)C1=C(C(=C(C=C1)O)O)O Z57124116 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.893 CC1=C(C(=C(C=C1)[N+](=O)[O-])C)N Z299600230 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.893 CC1=C(C(=C(C=C1)[N+](=O)[O-])C)O Z325174738 [0,2,0,0,0,0|1,0,0]=3 1003 B12R1.893 CC1=C(C(=O)C(=CN1)[N+](=O)[O-])C Z2301499812 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.893 CC1=C(C=CC(=C1C)C(=O)O)O Z1262516396 [0,2,0,0,0,0|1,0,1]=4 1005 B12R1.893 CC1=C(C=NC(=C1Br)Cl)[N+](=O)[O-] Z1269124878 [0,2,0,0,0,0|2,0,0]=4 1006 B12R1.893 O=C(O)C1=C(C(=C(C=C1)O)F)F Z1201621018 [0,2,0,0,0,0|1,0,1]=4 1007 B12R1.893 O=[N+]([O-])C1=C(C(=C(C=C1)F)F)F Z992434824 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)O)O Z1513616099 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)N)O)F Z2865634737 [0,2,0,0,0,0|2,0,0]=4 1010 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O Z1255416032 [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.1005 CC1=C(C(=CC(=C1)C(=O)O)N)O Z3098876941 [0,2,0,0,0,0|1,0,1]=4 1012 B12R1.1005 CC1=CC(=CC(=C1N)C)[N+](=O)[O-] Z1198152129 [0,2,0,0,0,0|1,0,0]=3 1013 B12R1.1005 NC1=C(C(=CC(=C1)C(=O)O)F)O Z2719327202 [0,2,0,0,0,0|1,0,1]=4 1014 B12R1.1005 NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br Z104474184 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Br)O)Br Z1269227546 [0,2,0,0,0,0|1,0,1]=4 1016 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)Br Z2310160029 [0,2,0,0,0,0|1,0,1]=4 1017 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)Cl Z1262519254 [0,2,0,0,0,0|1,0,1]=4 1018 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)F Z1097087058 [0,2,0,0,0,0|1,0,1]=4 1019 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)O)O)O Z104501122 [0,2,0,0,0,0|1,0,1]=4 1020 B12R1.1005 O=[N+]([O-])C1=CC(=C(C(=C1)Br)O)Br Z56926513 [0,2,0,0,0,0|0,0,0]=2 1021 B12R1.1005 O=[N+]([O-])C1=CC(=C(C(=C1)F)F)F Z452557398 [0,2,0,0,0,0|1,0,0]=3 1022 B12R1.16 CC1=CC=C(C=C1)C(=O)/C=C/[O-] Z199534162 [0,2,0,0,0,0|2,0,0]=4 1023 B12R1.16 CCNC(=O)C1=CC=C(C=C1)O Z183861716 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.16 CCOC(=O)C1=CC=C(C=C1)O Z53833636 [0,2,0,0,0,0|1,0,1]=4 1025 B12R1.16 O=C(/C=C/[O-])C1=CC=C(C=C1)Cl Z56943452 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)Cl Z1198164600 [0,2,0,0,0,0|1,0,1]=4 1027 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)F Z1198184471 [0,2,0,0,0,0|1,0,1]=4 1028 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)N Z1255399732 [0,2,0,0,0,0|1,0,1]=4 1029 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)O Z25218921 [0,2,0,0,0,0|1,0,1]=4 1030 B12R1.1703 O=C(CCl)C1=C(C=C(C=C1)O)O Z56886635 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.57 CC1=CC(=C(C=C1)[N+](=O)[O-])C=O Z1198181684 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.57 CC1=CC(=C(C=C1)[N+](=O)[O-])CO Z1255427186 [0,2,0,0,0,0|1,0,0]=3 1033 B12R1.57 COC1=C(C=CC(=C1)C)[N+](=O)[O-] Z202487574 [0,2,0,0,0,0|1,0,0]=3 1034 B12R1.57 COC1=C(C=CC(=C1)N)[N+](=O)[O-] Z4510487499 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.57 COC1=C(C=CC(=C1)O)[N+](=O)[O-] Z1255387801 [0,2,0,0,0,0|0,0,0]=2 1036 B12R1.57 O=CC1=C(C=CC(=C1)Br)[N+](=O)[O-] Z1269108736 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.57 O=CC1=C(C=CC(=C1)Cl)[N+](=O)[O-] Z1236003426 [0,2,0,0,0,0|1,0,0]=3 1038 B12R1.57 O=CC1=C(C=CC(=C1)F)[N+](=O)[O-] Z1201619355 [0,2,0,0,0,0|1,0,0]=3 1039 B12R1.57 O=CC1=C(C=CC(=C1)O)[N+](=O)[O-] Z1255390569 [0,2,0,0,0,0|0,0,0]=2 1040 B12R1.57 O=[N+]([O-])C1=C(C=C(C=C1)F)CBr Z316120798 [0,2,0,0,0,0|1,0,0]=3 1041 B12R1.57 O=[N+]([O-])C1=C(C=C(C=C1)O)CO Z1255360670 [0,2,0,0,0,0|0,0,0]=2 1042 B12R1.1000 CC(=O)C1=C(C=C(C=C1C)O)C Z1255419846 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.1000 CC1=C(C(=CC(=N1)O)O)[N+](=O)[O-] Z1198725011 [0,2,0,0,0,0|1,0,0]=3 1044 B12R1.1000 CC1=CC(=C(C(=O)N1)[N+](=O)[O-])C Z1198171570 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.1000 CC1=CC(=CC(=C1C(=O)O)C)O Z1201620717 [0,2,0,0,0,0|1,0,1]=4 1046 B12R1.1000 CC1=CC(=CC(=C1[N+](=O)[O-])C)O Z1255485872 [0,2,0,0,0,0|0,0,0]=2 1047 B12R1.1000 CC1=CC(=O)NC(=C1[N+](=O)[O-])C Z1255397718 [0,2,0,0,0,0|1,0,1]=4 1048 B12R1.1000 CC1=NC(=C(C(=C1)O)[N+](=O)[O-])C Z3235019636 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.1000 O=C(O)C1=C(C=C(C=C1F)O)F Z1201622051 [0,2,0,0,0,0|1,0,1]=4 1050 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,0,0,1,0,1|2,0,0]=4 1051 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,0,0,1,0,1|2,0,0]=4 1052 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [0,0,0,1,0,1|1,0,1]=4 1053 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [0,0,0,1,0,1|1,1,0]=4 1054 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [0,0,0,1,0,1|1,0,1]=4 1055 B12R2.612 O=C1CCC2=C1C=CC(=C2)O Z1255457932 [0,1,0,1,0,0|2,0,0]=4 1056 B12R2.612 O=C1COC2=C1C=CC(=C2)O Z111875098 [0,1,0,1,0,0|1,0,1]=4 1057 B12R2.612 O=C1NCC2=C1C=CC(=C2)O Z1198272536 [0,1,0,1,0,0|2,0,0]=4 1058 B12R2.612 O=C1OCC2=C1C=CC(=C2)O Z1198162647 [0,1,0,1,0,0|1,0,1]=4 1059 B8R1.7 O=S([O-])C1=CC=CS1 Z1398461604 [1,0,0,0,1,0|2,0,0]=4 1060 B8R1.7 O=[N+]([O-])C1=CNC=N1 Z235345333 [1,0,0,0,1,0|2,0,0]=4 1061 B8R1.7 O=[N+]([O-])C1=CNN=C1 Z235361263 [1,0,0,0,1,0|2,0,0]=4 1062 B8R1.7 O=[N+]([O-])C1=NC=CN1 Z1203162379 [1,0,0,0,1,0|2,0,0]=4 1063 B8R1.7 O=[N+]([O-])C1=NNC=C1 Z449369080 [1,0,0,0,1,0|2,0,0]=4 1064 B10R1.18 C/[N+](=C/C1=CC=NC=C1)/[O-] Z57107897 [1,0,0,0,0,1|2,0,0]=4 1065 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,0,0,0,1|2,0,0]=4 1066 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,0,0,0,1|2,0,0]=4 1067 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,0,0,0,1|2,0,0]=4 1068 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,0,0,0,1|1,0,1]=4 1069 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,0,0,0,0,1|0,0,0]=2 1070 B12R1.21 CC1=CC=C(C=C1)SC[N+](=O)[O-] Z2026405117 [0,0,0,0,0,2|1,0,0]=3 1071 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,0,0,0,0,2|2,0,0]=4 1072 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [0,0,0,0,0,2|1,0,1]=4 1073 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,0,0,0,0,2|1,0,1]=4 1074 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,0,0,0,0,2|1,0,1]=4 1075 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,0,0,0,0,2|1,0,1]=4 1076 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,0,0,0,0,2|1,0,1]=4 1077 B12R1.21 O=[N+]([O-])/C=C/C1=CC=C(C=C1)Cl Z208331660 [0,0,0,0,0,2|1,0,0]=3