0 B12R1.127 CC(=O)CC1=C(C=CC(=C1)F)Br Z992965748 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.127 CC(=O)CN1C=C(C=CC1=O)Br Z1863617790 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)C Z448251216 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)Cl Z1037552282 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Br Z56827897 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Cl Z276567178 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)C Z27065719 [0,0,0,0,0,0|4,0,0]=4 7 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)Cl Z28136791 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)N Z239121632 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.127 CC(=O)NC1=C(C=CC(=C1)F)C Z30904143 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.127 CC(=O)NC1=C(C=CC(=C1)I)Cl Z1408462342 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)C Z239120816 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)Cl Z431580096 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)F Z235362233 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)O Z1198342725 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.127 CC(O)CC1=C(C=CC(=C1)F)Br Z992976478 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.127 CC1=C(C=C(C=C1)Br)CC(=O)O Z1269235842 [0,0,0,0,0,0|2,0,0]=2 17 B12R1.127 CC1=C(C=C(C=C1)Br)NC(=O)N Z448250040 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.127 CC1=C(C=C(C=C1)O)C=C(Cl)Cl Z1269116545 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.127 CC1=C(C=C(C=N1)Cl)CC(=O)O Z1255468613 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.127 CC1=CC(=C(C=C1)Br)CC(=O)O Z1269198963 [0,0,0,0,0,0|2,0,0]=2 21 B12R1.127 CC1=CC(=C(C=C1)C)CC(=O)O Z234894443 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.127 CC1=CC(=C(C=C1)C)NC(=O)N Z56754686 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.127 CC1=CC(=C(C=C1)F)CC(=O)O Z982130030 [0,0,0,0,0,0|2,0,0]=2 24 B12R1.127 CC1=CN(C(=O)C=C1)CC(=O)O Z1255387472 [0,0,0,0,0,0|2,0,1]=3 25 B12R1.127 CC1=NC(=C(C=C1)Br)CC(=O)O Z1269158290 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.127 CC1=NN(C(=O)C=C1)CC(=O)O Z1041127720 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.127 CS(=O)CC1=C(C=CC(=C1)N)Cl Z802580894 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.127 NC(=O)CN1C=C(C=CC1=O)Br Z26317437 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.127 NC(=O)CN1C=C(C=CC1=O)N Z285226490 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.127 NC(=O)NC1=C(C=CC(=C1)I)Cl Z1410208208 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.127 NC(=O)NC1=C(C=CC(=C1)N)F Z239123692 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Br Z1269185355 [0,0,0,0,0,0|2,0,0]=2 33 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Cl Z1269155132 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)F Z285225836 [0,0,0,0,0,0|2,0,0]=2 35 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Cl)Br Z1269132555 [0,0,0,0,0,0|2,0,0]=2 36 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)Br Z285131566 [0,0,0,0,0,0|2,0,0]=2 37 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)F Z362118692 [0,0,0,0,0,0|2,0,0]=2 38 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)O Z1255403749 [0,0,0,0,0,0|1,0,0]=1 39 B12R1.127 O=C(O)CC1=C(C=CC(=C1)I)Br Z1269158801 [0,0,0,0,0,0|2,0,0]=2 40 B12R1.127 O=C(O)CC1=C(C=CC(=C1)O)Br Z1269121921 [0,0,0,0,0,0|1,0,0]=1 41 B12R1.127 O=C(O)CN1C=C(C=CC1=O)Br Z285172048 [0,0,0,0,0,0|2,0,1]=3 42 B12R1.127 O=C(O)CN1C=C(C=CC1=O)F Z1251354038 [0,0,0,0,0,0|2,0,1]=3 43 B12R1.127 O=C(O)CN1C=C(C=CC1=O)I Z1343908366 [0,0,0,0,0,0|2,0,1]=3 44 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,0,0,0,0,0|1,0,0]=2 48 B11R1.86 CC(=O)CC1=C(C=NC=C1)C Z4958080575 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.86 CC(=O)CN1C=CC=CC1=O Z1881599491 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.86 CC(=O)NC1=C(C=CC=C1)N Z239120544 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [1,0,0,0,0,0|1,0,0]=2 56 B11R1.86 CC1=C(C=CC=N1)CC(=O)O Z2050687800 [1,0,0,0,0,0|2,0,0]=3 57 B11R1.86 CC1=C(C=NC=C1)CC(=O)O Z1198264460 [1,0,0,0,0,0|2,0,0]=3 58 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,0,0,0,0,0|1,0,0]=2 65 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.86 NC1=C(C=CC=N1)CC(=O)O Z1889710265 [1,0,0,0,0,0|2,0,0]=3 69 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [1,0,0,0,0,0|1,0,0]=2 70 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [1,0,0,0,0,0|1,0,0]=2 71 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [1,0,0,0,0,0|1,0,0]=2 72 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [1,0,0,0,0,0|1,0,0]=2 73 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [1,0,0,0,0,0|0,0,0]=1 74 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl Z2096659743 [1,0,0,0,0,0|2,0,0]=3 75 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [1,0,0,0,0,0|1,0,0]=2 76 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br Z1269238080 [1,0,0,0,0,0|2,0,0]=3 77 B11R1.86 O=C(O)CC1=C(N=CC=N1)Cl Z1255421013 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.86 O=C(O)CC1=CN=CNC1=O Z4990166200 [1,0,0,0,0,0|2,0,1]=4 79 B11R1.86 O=C(O)CN1C=CC=CC1=O Z57985357 [1,0,0,0,0,0|1,0,1]=3 80 B11R1.86 O=C(O)CN1C=CC=NC1=O Z245435552 [1,0,0,0,0,0|2,0,1]=4 81 B11R1.86 O=C(O)CN1C=NC=CC1=O Z1154745738 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.86 O=[N+]([O-])CC1=C(C=CC=C1)F Z2182028452 [1,0,0,0,0,0|2,0,1]=4 83 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [1,0,0,0,0,0|2,0,1]=4 84 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,0,0,0,0,0|2,0,0]=3 86 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [1,0,0,0,0,0|3,0,0]=4 89 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [1,0,0,0,0,0|2,0,0]=3 91 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,0,0,0,0,0|2,0,1]=4 92 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,0,0,0,0,0|2,0,1]=4 93 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,0,0,0,0,0|3,0,0]=4 95 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,0,0,0,0,0|2,0,0]=3 98 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,0,0,0,0,0|2,0,0]=3 99 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,0,0,0,0,0|1,0,0]=2 100 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [1,0,0,0,0,0|3,0,0]=4 104 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,0,0,0,0,0|2,0,0]=3 105 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [1,0,0,0,0,0|2,1,0]=4 106 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,0,0,0,0,0|1,0,0]=2 107 B11R1.157 NC1=NC=CC(=C1)CC(=O)O Z1197888454 [1,0,0,0,0,0|2,0,0]=3 108 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,0,0,0,0,0|1,0,0]=2 109 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,0,0,0,0,0|1,0,0]=2 110 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,0,0,0,0,0|1,0,0]=2 111 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,0,0,0,0,0|1,0,0]=2 112 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,0,0,0,0,0|0,0,0]=1 113 B11R1.157 O=C(O)CC1=CC(=CN=C1)Br Z1269198419 [1,0,0,0,0,0|2,0,0]=3 114 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [1,0,0,0,0,0|1,0,0]=2 115 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [1,0,0,0,0,0|1,0,0]=2 116 B11R1.157 O=[N+]([O-])CC1=CC(=CC=C1)F Z2181775549 [1,0,0,0,0,0|2,0,1]=4 117 B11R1.182 CC1=CC(=C(C=C1)C)CC=O Z993017798 [1,0,0,0,0,0|2,0,0]=3 118 B11R1.182 COCC1=C(C=CC(=C1)O)N Z1262683212 [1,0,0,0,0,0|3,0,0]=4 119 B11R1.182 NCCC1=C(C=CC(=C1)O)Br Z3376089277 [1,0,0,0,0,0|2,0,1]=4 120 B11R1.182 OCCC1=C(C=CC(=C1)Br)O Z1269218042 [1,0,0,0,0,0|1,0,1]=3 121 B13R1.97 COC1=CC(=C(C=C1)Br)CC(=O)O Z1259136095 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.97 COC1=CC(=C(C=C1)Cl)CC(=O)O Z1269186781 [0,1,0,0,0,0|1,0,0]=2 123 B13R1.97 COC1=CC(=C(C=C1)F)CC(=O)O Z1255436471 [0,1,0,0,0,0|1,0,0]=2 124 B13R1.97 COC1=CC(=C(C=C1)O)CC(C)N Z4167757598 [0,1,0,0,0,0|2,0,1]=4 125 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)O)Br)Br Z1815156752 [0,1,0,0,0,0|3,0,0]=4 126 B13R1.876 CC1=C(C=C(C(=C1)F)CC(=O)O)F Z2235790638 [0,1,0,0,0,0|2,0,0]=3 127 B13R1.876 NC1=C(C=C(C(=C1)Br)CC(=O)O)N Z3325861056 [0,1,0,0,0,0|2,0,0]=3 128 B13R1.876 NC1=C(C=C(C(=C1)F)CC(=O)O)F Z1255388005 [0,1,0,0,0,0|2,0,0]=3 129 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)Cl)Br)F Z1939441447 [0,1,0,0,0,0|2,0,0]=3 130 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)F)Cl)Br Z2755932792 [0,1,0,0,0,0|2,0,0]=3 131 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)F)F)F Z1203162222 [0,1,0,0,0,0|2,0,0]=3 132 B13R1.885 CC(=O)CC1=C(C(=CC=C1F)Cl)F Z1269223931 [0,1,0,0,0,0|3,0,0]=4 133 B13R1.885 CC(=O)CC1=C(C(=CC=C1F)F)F Z1198331484 [0,1,0,0,0,0|3,0,0]=4 134 B13R1.885 O=C(O)CC1=C(C(=CC=C1Cl)O)Cl Z2310983643 [0,1,0,0,0,0|1,0,0]=2 135 B13R1.885 O=C(O)CC1=C(C(=CC=C1F)Br)F Z1269116160 [0,1,0,0,0,0|2,0,0]=3 136 B13R1.885 O=C(O)CC1=C(C(=CC=C1F)F)Br Z2310164842 [0,1,0,0,0,0|2,0,0]=3 137 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)F)Br Z1269238280 [0,1,0,0,0,0|2,0,0]=3 138 B13R1.897 NC(C(=O)O)C1=C(C=CC(=C1)F)F Z415636520 [0,1,0,0,0,0|2,0,0]=3 139 B13R1.897 O=C(O)C(=O)C1=C(C=CC(=C1)F)F Z381360846 [0,1,0,0,0,0|2,0,1]=4 140 B13R1.2816 CC(=O)NC1=C(C(=CC(=C1)Cl)Br)O Z1338308127 [0,1,0,0,0,0|3,0,0]=4 141 B13R1.2816 O=C(O)CC1=C(C(=CC(=C1)F)F)Br Z2310164838 [0,1,0,0,0,0|2,0,0]=3 142 B13R1.2816 O=C(O)CN1C=C(C=C(C1=O)Cl)Br Z1813133433 [0,1,0,0,0,0|2,0,1]=4 143 B13R1.2816 O=C(O)CN1C=C(C=C(C1=O)I)Br Z5011950319 [0,1,0,0,0,0|2,0,1]=4 144 B13R1.2872 COC(=O)CC1=C(C=CC(=C1)Br)C Z1269225209 [0,1,0,0,0,0|2,0,0]=3 145 B13R1.2872 COC(=O)CC1=C(C=CC(=C1)F)Br Z1322793770 [0,1,0,0,0,0|2,0,0]=3 146 B13R1.2872 COC(=O)CC1=C(C=CC(=C1)O)Br Z1269243407 [0,1,0,0,0,0|1,0,0]=2 147 B13R1.2872 COC(=O)CC1=C(N=NC(=C1)O)O Z3710554492 [0,1,0,0,0,0|2,0,0]=3 148 B13R1.2872 COC(=O)NC1=C(C=CC(=C1)N)F Z319610158 [0,1,0,0,0,0|3,0,0]=4 149 B13R1.2872 CON(C)CC1=C(C=CC(=C1)O)Cl Z2702998209 [0,1,0,0,0,0|3,0,0]=4 150 B13R1.2872 O=C(CO)NC1=C(C=CC(=C1)Cl)Cl Z107728854 [0,1,0,0,0,0|3,0,0]=4 151 B13R1.3089 COC1=C(C=C(C=C1)Br)CC(=O)O Z823810504 [0,1,0,0,0,0|1,0,0]=2 152 B13R1.3089 COC1=C(C=C(C=C1)C)CC(=O)N Z101186034 [0,1,0,0,0,0|2,0,0]=3 153 B13R1.3089 COC1=C(C=C(C=C1)C)CC(=O)O Z94601335 [0,1,0,0,0,0|1,0,0]=2 154 B13R1.3089 COC1=C(C=C(C=C1)Cl)CC(=O)N Z116821720 [0,1,0,0,0,0|2,0,0]=3 155 B13R1.3089 COC1=C(C=C(C=C1)Cl)CC(=O)O Z104346730 [0,1,0,0,0,0|1,0,0]=2 156 B13R1.3089 COC1=C(C=C(C=C1)F)CC(=O)N Z1251361184 [0,1,0,0,0,0|2,0,0]=3 157 B13R1.3089 COC1=C(C=C(C=C1)F)CC(=O)O Z1255372895 [0,1,0,0,0,0|1,0,0]=2 158 B13R1.3089 COC1=C(C=C(C=C1)N)NC(=O)C Z235363149 [0,1,0,0,0,0|3,0,0]=4 159 B13R1.3089 COC1=C(C=C(C=N1)Br)CC(=O)O Z1269125783 [0,1,0,0,0,0|2,0,0]=3 160 B13R1.3089 CSC1=C(C=C(C=C1)Br)CC(=O)O Z2733578908 [0,1,0,0,0,0|1,1,0]=3 161 B13R1.3089 N#CC1=C(C=C(C=C1)Br)CC(=O)O Z1269131728 [0,1,0,0,0,0|2,0,0]=3 162 B13R1.3089 O=C([O-])C[N+]1=C(C=CC(=C1)O)CO Z1255498732 [0,1,0,0,0,0|1,0,1]=3 163 B11R0.32 O=C(O)/C=C(/CC(=O)O)\C(=O)O Z57204893 [0,0,1,0,0,0|2,0,0]=3 164 B13R2.155 NC1=CC2=C(C=C1)OCC(=O)N2 Z147646768 [0,0,0,1,0,0|3,0,0]=4 165 B13R2.155 O=C1C=CC2=C(N1)C=C(C=C2)O Z1198164610 [0,0,0,1,0,0|3,0,0]=4 166 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)O Z57150899 [0,0,0,1,0,0|3,0,0]=4 167 B13R2.155 O=C1CC2=C(C=CC(=C2)Br)CN1 Z1813375979 [0,0,0,1,0,0|3,0,0]=4 168 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)O Z1255450792 [0,0,0,1,0,0|3,0,0]=4 169 B13R2.155 O=C1COC2=C(C1)C=C(C=C2)Br Z1269182618 [0,0,0,1,0,0|2,0,0]=3 170 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Br Z227266368 [0,0,0,1,0,0|3,0,0]=4 171 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Cl Z57515847 [0,0,0,1,0,0|3,0,0]=4 172 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)F Z1255450712 [0,0,0,1,0,0|3,0,0]=4 173 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)O Z1255458499 [0,0,0,1,0,0|2,0,0]=3 174 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)O Z2963142130 [0,0,0,1,0,0|3,0,0]=4 175 B13R2.155 OC1=CC2=C(C=C1)C=CC(=C2)O Z104495344 [0,0,0,1,0,0|2,0,1]=4 176 B13R2.155 OC1=CC2=C(C=C1)CCC(C2)O Z1513811314 [0,0,0,1,0,0|2,0,1]=4 177 B13R2.4930 CC1=CC2=C(C=C1)CC2C(=O)O Z2719072266 [0,0,0,1,0,0|2,0,0]=3 178 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)Cl Z1262559583 [0,0,0,1,0,0|2,0,0]=3 179 B13R2.5139 CC1=C2NC(=O)CC2=C(C=C1)Br Z1269124374 [0,0,0,1,0,0|3,0,0]=4 180 B13R2.5139 CC1=C2NC(=O)CC2=C(C=C1)Cl Z1335028339 [0,0,0,1,0,0|3,0,0]=4 181 B13R2.5139 O=C1CC2=C(C=CC(=C2N1)Cl)Br Z1335028398 [0,0,0,1,0,0|3,0,0]=4 182 B13R2.5139 O=C1CC2=C(C=CC(=C2N1)Cl)Cl Z1269200991 [0,0,0,1,0,0|3,0,0]=4 183 B13R2.5139 O=C1CC2=C(C=CC(=C2N1)F)Br Z1269232121 [0,0,0,1,0,0|3,0,0]=4 184 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)F Z1269120232 [0,0,0,0,1,0|3,0,0]=4 185 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)O Z104500026 [0,0,0,0,1,0|2,0,0]=3 186 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)C Z104486864 [0,0,0,0,1,0|3,0,0]=4 187 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)F Z1020765768 [0,0,0,0,1,0|3,0,0]=4 188 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)O Z85923114 [0,0,0,0,1,0|2,0,0]=3 189 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)Cl Z56963405 [0,0,0,0,1,0|3,0,0]=4 190 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)N Z1198173283 [0,0,0,0,1,0|3,0,0]=4 191 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)O Z57101024 [0,0,0,0,1,0|2,0,0]=3 192 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)F Z57046229 [0,0,0,0,1,0|3,0,0]=4 193 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)N Z1198233574 [0,0,0,0,1,0|3,0,0]=4 194 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)O Z56858268 [0,0,0,0,1,0|2,0,0]=3 195 B11R1.167 CC(=O)C1=C(C=CC(=C1)I)Br Z1269211640 [0,0,0,0,1,0|3,0,0]=4 196 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)C Z1203581134 [0,0,0,0,1,0|3,0,0]=4 197 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)F Z2037273341 [0,0,0,0,1,0|3,0,0]=4 198 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)F Z1198184516 [0,0,0,0,1,0|2,0,0]=3 199 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)N Z1255417279 [0,0,0,0,1,0|2,0,0]=3 200 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O Z56889030 [0,0,0,0,1,0|1,0,0]=2 201 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [0,0,0,0,1,0|2,0,1]=4 202 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)N Z1259107965 [0,0,0,0,1,0|3,0,0]=4 203 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O Z1255526918 [0,0,0,0,1,0|2,0,0]=3 204 B11R1.167 CC1=C(C=C(C=C1)Cl)C(=O)O Z1203161815 [0,0,0,0,1,0|2,0,0]=3 205 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)O Z203881854 [0,0,0,0,1,0|2,0,0]=3 206 B11R1.167 CC1=C(C=C(C=C1)I)C(=O)O Z1269149718 [0,0,0,0,1,0|2,0,0]=3 207 B11R1.167 CC1=C(C=C(C=C1)N)C(=O)N Z802642238 [0,0,0,0,1,0|3,0,0]=4 208 B11R1.167 CC1=C(C=C(C=C1)N)C(=O)O Z802851852 [0,0,0,0,1,0|2,0,0]=3 209 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)N Z1255405404 [0,0,0,0,1,0|2,0,0]=3 210 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)O Z1255379858 [0,0,0,0,1,0|1,0,0]=2 211 B11R1.167 CC1=C(C=C(C=N1)Br)C(=O)O Z1139192309 [0,0,0,0,1,0|3,0,0]=4 212 B11R1.167 CC1=C(C=C(C=N1)N)C(=O)O Z802851812 [0,0,0,0,1,0|3,0,0]=4 213 B11R1.167 CC1=C(C=C(N=C1)Cl)C(=O)O Z1255420966 [0,0,0,0,1,0|3,0,0]=4 214 B11R1.167 CC1=C(C=C(N=C1)F)C(=O)O Z1255444774 [0,0,0,0,1,0|3,0,0]=4 215 B11R1.167 CC1=C(N=C(C=C1)Br)C(=O)O Z1269212559 [0,0,0,0,1,0|3,0,0]=4 216 B11R1.167 CC1=C(N=C(C=C1)Cl)C(=O)O Z3234879051 [0,0,0,0,1,0|3,0,0]=4 217 B11R1.167 CC1=C(N=C(C=C1)F)C(=O)O Z1255366995 [0,0,0,0,1,0|3,0,0]=4 218 B11R1.167 CC1=C(N=C(C=C1)N)C(=O)O Z2027324730 [0,0,0,0,1,0|3,0,0]=4 219 B11R1.167 CC1=CC(=C(C=C1)Br)C(=O)O Z1269210419 [0,0,0,0,1,0|2,0,0]=3 220 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)O Z85921039 [0,0,0,0,1,0|2,0,0]=3 221 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O Z732710380 [0,0,0,0,1,0|2,0,0]=3 222 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O Z979715400 [0,0,0,0,1,0|2,0,0]=3 223 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)N Z992346212 [0,0,0,0,1,0|3,0,0]=4 224 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)O Z111833788 [0,0,0,0,1,0|2,0,0]=3 225 B11R1.167 CC1=CC(=C(C=C1)O)B(O)O Z1255446870 [0,0,0,0,1,0|2,0,1]=4 226 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)O Z147642456 [0,0,0,0,1,0|1,0,0]=2 227 B11R1.167 CC1=CC(=C(C=C1)O)[N+](=O)[O-] Z85939128 [0,0,0,0,1,0|2,0,1]=4 228 B11R1.167 CC1=CC(=C(N=C1)Cl)C(=O)O Z1198173148 [0,0,0,0,1,0|3,0,0]=4 229 B11R1.167 CC1=CC(=C(N=C1)F)C(=O)O Z1255396165 [0,0,0,0,1,0|3,0,0]=4 230 B11R1.167 CC1=CC(=C(N=C1)N)C(=O)O Z1197890692 [0,0,0,0,1,0|3,0,0]=4 231 B11R1.167 CC1=CN=C(C=C1C(=O)O)C Z3182541714 [0,0,0,0,1,0|3,0,0]=4 232 B11R1.167 CC1=NC(=C(C=C1)Br)C(=O)O Z1269136490 [0,0,0,0,1,0|3,0,0]=4 233 B11R1.167 CC1=NC(=C(C=C1)C)C(=O)O Z3272981162 [0,0,0,0,1,0|3,0,0]=4 234 B11R1.167 CC1=NC(=C(C=C1)F)C(=O)O Z4646465276 [0,0,0,0,1,0|3,0,0]=4 235 B11R1.167 CC1=NC(=C(C=C1)O)C(=O)O Z1255363761 [0,0,0,0,1,0|2,0,0]=3 236 B11R1.167 CC1=NC=C(C(=C1)C(=O)O)Br Z1269171533 [0,0,0,0,1,0|3,0,0]=4 237 B11R1.167 CN1C=CC(=O)C(=C1)C(=O)O Z1255493292 [0,0,0,0,1,0|2,0,1]=4 238 B11R1.167 N=C(N)C1=C(C=CC(=C1)Cl)O Z1849013983 [0,0,0,0,1,0|3,0,0]=4 239 B11R1.167 NC(=O)C1=C(C=CC(=C1)Br)N Z424995924 [0,0,0,0,1,0|3,0,0]=4 240 B11R1.167 NC(=O)C1=C(C=CC(=C1)Br)O Z68590257 [0,0,0,0,1,0|2,0,0]=3 241 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)F Z116821726 [0,0,0,0,1,0|3,0,0]=4 242 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)N Z239125320 [0,0,0,0,1,0|3,0,0]=4 243 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)O Z57032581 [0,0,0,0,1,0|2,0,0]=3 244 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)Br Z101186138 [0,0,0,0,1,0|3,0,0]=4 245 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)N Z376434962 [0,0,0,0,1,0|3,0,0]=4 246 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)O Z1255466467 [0,0,0,0,1,0|2,0,0]=3 247 B11R1.167 NC(=O)C1=C(C=CC(=C1)I)O Z68590383 [0,0,0,0,1,0|2,0,0]=3 248 B11R1.167 NC(=O)C1=C(C=CC(=C1)N)Cl Z239125310 [0,0,0,0,1,0|3,0,0]=4 249 B11R1.167 NC(=O)C1=C(C=CC(=C1)N)F Z316119778 [0,0,0,0,1,0|3,0,0]=4 250 B11R1.167 NC1=C(C=C(C=C1)Br)C(=O)O Z104484428 [0,0,0,0,1,0|2,0,0]=3 251 B11R1.167 NC1=C(C=C(C=C1)Cl)C(=O)O Z104485568 [0,0,0,0,1,0|2,0,0]=3 252 B11R1.167 NC1=C(C=C(C=C1)F)C(=O)O Z56946871 [0,0,0,0,1,0|2,0,0]=3 253 B11R1.167 NC1=C(C=C(C=C1)I)C(=O)O Z56754067 [0,0,0,0,1,0|2,0,0]=3 254 B11R1.167 NC1=C(C=C(C=C1)O)C(=O)O Z104474092 [0,0,0,0,1,0|1,0,0]=2 255 B11R1.167 NC1=C(C=C(C=C1)O)[N+](=O)[O-] Z431554226 [0,0,0,0,1,0|2,0,1]=4 256 B11R1.167 NC1=C(C=C(C=N1)Br)C(=O)O Z905189356 [0,0,0,0,1,0|3,0,0]=4 257 B11R1.167 NC1=C(C=C(C=N1)O)C(=O)O Z2491075097 [0,0,0,0,1,0|2,0,0]=3 258 B11R1.167 NC1=C(C=C(N=C1)Cl)C(=O)O Z1198169548 [0,0,0,0,1,0|3,0,0]=4 259 B11R1.167 NC1=C(N=C(C=C1)Cl)C(=O)O Z1198219371 [0,0,0,0,1,0|3,0,0]=4 260 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O Z902266056 [0,0,0,0,1,0|2,0,0]=3 261 B11R1.167 NC1=CC(=C(C=C1)Cl)C(=O)O Z214391864 [0,0,0,0,1,0|2,0,0]=3 262 B11R1.167 NC1=CC(=C(C=C1)F)C(=O)O Z235362843 [0,0,0,0,1,0|2,0,0]=3 263 B11R1.167 NC1=CC(=C(C=C1)O)C(=O)O Z57127471 [0,0,0,0,1,0|1,0,0]=2 264 B11R1.167 NC1=CC(=C(C=C1)O)[N+](=O)[O-] Z1255398898 [0,0,0,0,1,0|2,0,1]=4 265 B11R1.167 NC1=NC(=C(C=C1)Br)C(=O)O Z1269112071 [0,0,0,0,1,0|3,0,0]=4 266 B11R1.167 NC1=NC=C(C(=C1)C(=O)O)Br Z1269174740 [0,0,0,0,1,0|3,0,0]=4 267 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)Cl Z104478416 [0,0,0,0,1,0|2,0,0]=3 268 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)F Z104510340 [0,0,0,0,1,0|2,0,0]=3 269 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)I Z56921138 [0,0,0,0,1,0|2,0,0]=3 270 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)O Z104500554 [0,0,0,0,1,0|1,0,0]=2 271 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)Br Z317098896 [0,0,0,0,1,0|2,0,0]=3 272 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)Cl Z104475668 [0,0,0,0,1,0|2,0,0]=3 273 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)F Z107365798 [0,0,0,0,1,0|2,0,0]=3 274 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)I Z239685226 [0,0,0,0,1,0|2,0,0]=3 275 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)O Z104500560 [0,0,0,0,1,0|1,0,0]=2 276 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)S Z838079260 [0,0,0,0,1,0|1,1,0]=3 277 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)Br Z104510142 [0,0,0,0,1,0|2,0,0]=3 278 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)Cl Z1201619425 [0,0,0,0,1,0|2,0,0]=3 279 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)F Z89265799 [0,0,0,0,1,0|2,0,0]=3 280 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)I Z317078348 [0,0,0,0,1,0|2,0,0]=3 281 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)O Z367679206 [0,0,0,0,1,0|1,0,0]=2 282 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)Cl Z1269238996 [0,0,0,0,1,0|2,0,0]=3 283 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)F Z1269165995 [0,0,0,0,1,0|2,0,0]=3 284 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)I Z1037337344 [0,0,0,0,1,0|2,0,0]=3 285 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)Cl Z1201622697 [0,0,0,0,1,0|1,0,0]=2 286 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)O Z275164274 [0,0,0,0,1,0|0,0,0]=1 287 B11R1.167 O=C(O)C1=C(C=CC(=C1)S)F Z1255439840 [0,0,0,0,1,0|1,1,0]=3 288 B11R1.167 O=C(O)C1=C(C=CC(=N1)Br)Br Z1269213502 [0,0,0,0,1,0|3,0,0]=4 289 B11R1.167 O=C(O)C1=C(C=CC(=N1)Br)Cl Z1269166820 [0,0,0,0,1,0|3,0,0]=4 290 B11R1.167 O=C(O)C1=C(C=CC(=N1)Br)F Z1269143740 [0,0,0,0,1,0|3,0,0]=4 291 B11R1.167 O=C(O)C1=C(C=CC(=N1)Cl)Br Z1269114031 [0,0,0,0,1,0|3,0,0]=4 292 B11R1.167 O=C(O)C1=C(C=CC(=N1)Cl)Cl Z56846826 [0,0,0,0,1,0|3,0,0]=4 293 B11R1.167 O=C(O)C1=C(C=CC(=N1)Cl)F Z1198165230 [0,0,0,0,1,0|3,0,0]=4 294 B11R1.167 O=C(O)C1=C(C=CC(=N1)F)Br Z1269115841 [0,0,0,0,1,0|3,0,0]=4 295 B11R1.167 O=C(O)C1=C(C=CC(=N1)F)Cl Z1255428948 [0,0,0,0,1,0|3,0,0]=4 296 B11R1.167 O=C(O)C1=C(C=NC(=C1)Br)Br Z1269135997 [0,0,0,0,1,0|3,0,0]=4 297 B11R1.167 O=C(O)C1=C(C=NC(=C1)Br)Cl Z1269168929 [0,0,0,0,1,0|3,0,0]=4 298 B11R1.167 O=C(O)C1=C(C=NC(=C1)Br)F Z1269195927 [0,0,0,0,1,0|3,0,0]=4 299 B11R1.167 O=C(O)C1=C(C=NC(=C1)Cl)Br Z1269212593 [0,0,0,0,1,0|3,0,0]=4 300 B11R1.167 O=C(O)C1=C(C=NC(=C1)Cl)Cl Z1255450473 [0,0,0,0,1,0|3,0,0]=4 301 B11R1.167 O=C(O)C1=C(C=NC(=C1)Cl)F Z1198165225 [0,0,0,0,1,0|3,0,0]=4 302 B11R1.167 O=C(O)C1=C(C=NC(=C1)F)F Z1198183201 [0,0,0,0,1,0|3,0,0]=4 303 B11R1.167 O=C(O)C1=C(N=CC(=C1)Br)Br Z977014668 [0,0,0,0,1,0|3,0,0]=4 304 B11R1.167 O=C(O)C1=C(N=CC(=C1)Br)Cl Z414834410 [0,0,0,0,1,0|3,0,0]=4 305 B11R1.167 O=C(O)C1=C(N=CC(=C1)Br)F Z977029604 [0,0,0,0,1,0|3,0,0]=4 306 B11R1.167 O=C(O)C1=C(N=CC(=C1)Br)O Z905187892 [0,0,0,0,1,0|2,0,0]=3 307 B11R1.167 O=C(O)C1=C(N=CC(=C1)Cl)Br Z1269240407 [0,0,0,0,1,0|3,0,0]=4 308 B11R1.167 O=C(O)C1=C(N=CC(=C1)Cl)Cl Z1201621435 [0,0,0,0,1,0|3,0,0]=4 309 B11R1.167 O=C(O)C1=C(N=CC(=C1)F)Cl Z1203162362 [0,0,0,0,1,0|3,0,0]=4 310 B11R1.167 O=C(O)C1=C(N=CC(=C1)F)F Z1201624187 [0,0,0,0,1,0|3,0,0]=4 311 B11R1.167 O=C(O)C1=C(N=CC(=C1)F)O Z1198165239 [0,0,0,0,1,0|2,0,0]=3 312 B11R1.167 O=C1C=C(C(=CN1)Br)C(=O)O Z2894089817 [0,0,0,0,1,0|2,0,1]=4 313 B11R1.167 O=[N+]([O-])C1=C(C=CC(=C1)F)O Z415740526 [0,0,0,0,1,0|2,0,1]=4 314 B11R1.167 OB(O)C1=C(C=CC(=C1)F)O Z1201622111 [0,0,0,0,1,0|2,0,1]=4 315 B11R1.495 O=C(O)CN1C(=O)C=CC1=O Z245319574 [0,0,0,0,1,0|1,0,2]=4 316 B11R1.645 CC1=CC(=C(S1)C)CC(=O)O Z978942534 [0,0,0,0,1,0|3,0,0]=4 317 B11R1.645 CC1=CC(=C(S1)CC(=O)O)C Z1262558154 [0,0,0,0,1,0|3,0,0]=4 318 B11R1.645 O=C(O)CC1=C(SC(=C1)Br)Br Z3304638006 [0,0,0,0,1,0|3,0,0]=4 319 B13R1.893 CC1=C(C=C(C=C1)Cl)NCC(=O)N Z105004294 [0,0,0,0,0,1|3,0,0]=4 320 B13R1.893 CC1=C(C=C(C=C1)Cl)OCC(=O)O Z274764854 [0,0,0,0,0,1|2,0,0]=3 321 B13R1.893 CC1=C(C=C(C=C1)F)NCC(=O)N Z104831288 [0,0,0,0,0,1|3,0,0]=4 322 B13R1.893 CC1=CC(=C(C=C1)C)NCC(=O)N Z104549838 [0,0,0,0,0,1|3,0,0]=4 323 B13R1.893 CC1=CC(=C(C=C1)C)OCC(=O)N Z18468017 [0,0,0,0,0,1|3,0,0]=4 324 B13R1.893 CC1=CC(=C(C=C1)C)OCC(=O)O Z56820968 [0,0,0,0,0,1|2,0,0]=3 325 B13R1.893 CC1=CC(=C(C=C1)C)SCC(=O)O Z55903768 [0,0,0,0,0,1|2,0,0]=3 326 B13R1.893 CC1=CC(=C(C=C1)Cl)OCC(=O)N Z16115067 [0,0,0,0,0,1|3,0,0]=4 327 B13R1.893 CC1=CC(=C(C=C1)Cl)OCC(=O)O Z56899213 [0,0,0,0,0,1|2,0,0]=3 328 B13R1.893 CC1=CC(=C(C=C1)F)OCC(=O)O Z1250417296 [0,0,0,0,0,1|2,0,0]=3 329 B13R1.893 NC(=O)COC1=C(C=CC(=C1)Cl)Cl Z14775230 [0,0,0,0,0,1|3,0,0]=4 330 B13R1.893 NC(=O)CSC1=C(C=CC(=C1)Cl)Cl Z25212437 [0,0,0,0,0,1|3,0,0]=4 331 B13R1.893 O=C(O)/C=C/C1=C(C=CC(=C1)Br)F Z56955960 [0,0,0,0,0,1|2,0,1]=4 332 B13R1.893 O=C(O)/C=C/C1=C(C=CC(=C1)Cl)Br Z1269118852 [0,0,0,0,0,1|2,0,1]=4 333 B13R1.893 O=C(O)/C=C/C1=C(C=CC(=C1)Cl)Cl Z2895090861 [0,0,0,0,0,1|2,0,1]=4 334 B13R1.893 O=C(O)/C=C/C1=C(C=CC(=C1)F)F Z2942852737 [0,0,0,0,0,1|2,0,1]=4 335 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)Br)F Z426022294 [0,0,0,0,0,1|2,0,0]=3 336 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)Cl)Br Z1269137463 [0,0,0,0,0,1|2,0,0]=3 337 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)F)Br Z426022162 [0,0,0,0,0,1|2,0,0]=3 338 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)F)F Z415635744 [0,0,0,0,0,1|2,0,0]=3 339 B13R1.893 O=C(O)CCN1C=C(C=CC1=O)Br Z285172050 [0,0,0,0,0,1|2,0,1]=4 340 B13R1.893 O=C(O)COC1=C(C=CC(=C1)Cl)Cl Z57455032 [0,0,0,0,0,1|2,0,0]=3 341 B13R1.893 O=C(O)COC1=C(C=CC(=C1)Cl)O Z56788158 [0,0,0,0,0,1|1,0,0]=2 342 B13R1.893 O=C(O)COC1=C(C=CC(=C1)F)F Z1117890486 [0,0,0,0,0,1|2,0,0]=3 343 B13R1.893 O=C(O)CSC1=C(C=CC(=C1)Cl)Cl Z55903787 [0,0,0,0,0,1|2,0,0]=3 344 B13R1.893 O=C(O)CSC1=C(C=CC(=C1)F)F Z92608891 [0,0,0,0,0,1|2,0,0]=3 345 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [2,0,0,0,0,0|1,0,0]=3 346 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [2,0,0,0,0,0|1,0,0]=3 347 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [2,0,0,0,0,0|2,0,0]=4 348 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [2,0,0,0,0,0|2,0,0]=4 349 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [2,0,0,0,0,0|1,0,1]=4 350 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [2,0,0,0,0,0|1,0,1]=4 351 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [2,0,0,0,0,0|1,0,1]=4 352 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [2,0,0,0,0,0|1,0,0]=3 353 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [2,0,0,0,0,0|1,0,0]=3 354 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [2,0,0,0,0,0|1,0,1]=4 355 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [2,0,0,0,0,0|1,0,1]=4 356 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [2,0,0,0,0,0|2,0,0]=4 357 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [2,0,0,0,0,0|2,0,0]=4 358 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [2,0,0,0,0,0|1,0,1]=4 359 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [2,0,0,0,0,0|2,0,0]=4 360 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [2,0,0,0,0,0|1,0,0]=3 361 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [2,0,0,0,0,0|2,0,0]=4 362 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [2,0,0,0,0,0|2,0,0]=4 363 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [2,0,0,0,0,0|1,1,0]=4 364 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [2,0,0,0,0,0|1,0,0]=3 365 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [2,0,0,0,0,0|1,0,0]=3 366 B10R1.18 O=C(O)CC1=CN=CN=C1 Z1889902548 [2,0,0,0,0,0|2,0,0]=4 367 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [2,0,0,0,0,0|1,0,0]=3 368 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [2,0,0,0,0,0|1,0,1]=4 369 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [2,0,0,0,0,0|1,0,1]=4 370 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [2,0,0,0,0,0|2,0,0]=4 371 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [2,0,0,0,0,0|2,0,0]=4 372 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [2,0,0,0,0,0|1,0,1]=4 373 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [2,0,0,0,0,0|1,0,1]=4 374 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [2,0,0,0,0,0|2,0,0]=4 375 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [2,0,0,0,0,0|1,0,1]=4 376 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [2,0,0,0,0,0|1,0,0]=3 377 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [2,0,0,0,0,0|1,0,0]=3 378 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [2,0,0,0,0,0|1,0,0]=3 379 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [2,0,0,0,0,0|1,0,1]=4 380 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [2,0,0,0,0,0|1,0,1]=4 381 B10R1.30 CC1=C(C=C(C=C1)Br)C=O Z871801782 [2,0,0,0,0,0|2,0,0]=4 382 B10R1.30 CC1=C(C=C(C=C1)Br)CO Z1259109160 [2,0,0,0,0,0|2,0,0]=4 383 B10R1.30 CC1=C(C=C(C=C1)Cl)C=O Z871801780 [2,0,0,0,0,0|2,0,0]=4 384 B10R1.30 CC1=C(C=C(C=C1)F)C=O Z1080470282 [2,0,0,0,0,0|2,0,0]=4 385 B10R1.30 CC1=C(C=C(C=C1)N)CO Z1203578809 [2,0,0,0,0,0|2,0,0]=4 386 B10R1.30 CC1=C(C=C(C=C1)O)CN Z2672012535 [2,0,0,0,0,0|2,0,0]=4 387 B10R1.30 CC1=CC(=C(C=C1)Br)C=O Z871833034 [2,0,0,0,0,0|2,0,0]=4 388 B10R1.30 CC1=CC(=C(C=C1)Br)CO Z1269153193 [2,0,0,0,0,0|2,0,0]=4 389 B10R1.30 CC1=CC(=C(C=C1)C)C=O Z104479610 [2,0,0,0,0,0|2,0,0]=4 390 B10R1.30 CC1=CC(=C(C=C1)Cl)C=O Z871801784 [2,0,0,0,0,0|2,0,0]=4 391 B10R1.30 CC1=CC(=C(C=C1)F)C=O Z732814056 [2,0,0,0,0,0|2,0,0]=4 392 B10R1.30 CC1=CC(=C(C=C1)F)CO Z992343034 [2,0,0,0,0,0|2,0,0]=4 393 B10R1.30 CC1=CC(=C(C=C1)I)CO Z1269210139 [2,0,0,0,0,0|2,0,0]=4 394 B10R1.30 CC1=CC(=C(C=C1)N)CO Z1203578305 [2,0,0,0,0,0|2,0,0]=4 395 B10R1.30 CC1=CC(=C(C=C1)O)C=O Z274774390 [2,0,0,0,0,0|1,0,0]=3 396 B10R1.30 CC1=NC(=C(C=C1)O)C=O Z1104852896 [2,0,0,0,0,0|2,0,0]=4 397 B10R1.30 CC1=NC(=C(C=C1)O)CO Z1104852895 [2,0,0,0,0,0|2,0,0]=4 398 B10R1.30 CCC1=C(C=CC(=C1)Br)O Z1269214466 [2,0,0,0,0,0|1,0,1]=4 399 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [2,0,0,0,0,0|0,0,1]=3 400 B10R1.30 NC1=C(C=C(C=C1)Br)C=O Z1269131915 [2,0,0,0,0,0|2,0,0]=4 401 B10R1.30 NC1=C(C=C(C=C1)Br)CO Z1269160989 [2,0,0,0,0,0|2,0,0]=4 402 B10R1.30 NC1=C(C=C(C=C1)F)CO Z424770278 [2,0,0,0,0,0|2,0,0]=4 403 B10R1.30 NC1=CC(=C(C=C1)Cl)CO Z394691946 [2,0,0,0,0,0|2,0,0]=4 404 B10R1.30 NCC1=C(C=CC(=C1)Br)O Z57102487 [2,0,0,0,0,0|2,0,0]=4 405 B10R1.30 NCC1=C(C=CC(=C1)Cl)O Z594413668 [2,0,0,0,0,0|2,0,0]=4 406 B10R1.30 NCC1=C(C=CC(=C1)N)O Z2786366737 [2,0,0,0,0,0|2,0,0]=4 407 B10R1.30 NCC1=C(C=CC(=C1)O)Cl Z2768234857 [2,0,0,0,0,0|2,0,0]=4 408 B10R1.30 NCC1=C(C=CC(=C1)O)F Z4502872788 [2,0,0,0,0,0|2,0,0]=4 409 B10R1.30 NCC1=C(C=CC(=C1)O)O Z2757657768 [2,0,0,0,0,0|1,0,0]=3 410 B10R1.30 O=CC1=C(C=CC(=C1)Br)Br Z385370000 [2,0,0,0,0,0|2,0,0]=4 411 B10R1.30 O=CC1=C(C=CC(=C1)Br)Cl Z871801788 [2,0,0,0,0,0|2,0,0]=4 412 B10R1.30 O=CC1=C(C=CC(=C1)Br)F Z104482596 [2,0,0,0,0,0|2,0,0]=4 413 B10R1.30 O=CC1=C(C=CC(=C1)Br)I Z1269213434 [2,0,0,0,0,0|2,0,0]=4 414 B10R1.30 O=CC1=C(C=CC(=C1)Br)O Z57313901 [2,0,0,0,0,0|1,0,0]=3 415 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Br Z871833038 [2,0,0,0,0,0|2,0,0]=4 416 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Cl Z871801786 [2,0,0,0,0,0|2,0,0]=4 417 B10R1.30 O=CC1=C(C=CC(=C1)Cl)F Z819785594 [2,0,0,0,0,0|2,0,0]=4 418 B10R1.30 O=CC1=C(C=CC(=C1)Cl)I Z1269163931 [2,0,0,0,0,0|2,0,0]=4 419 B10R1.30 O=CC1=C(C=CC(=C1)Cl)O Z57772439 [2,0,0,0,0,0|1,0,0]=3 420 B10R1.30 O=CC1=C(C=CC(=C1)F)Br Z1079442476 [2,0,0,0,0,0|2,0,0]=4 421 B10R1.30 O=CC1=C(C=CC(=C1)F)Cl Z1201622451 [2,0,0,0,0,0|2,0,0]=4 422 B10R1.30 O=CC1=C(C=CC(=C1)F)F Z385369882 [2,0,0,0,0,0|2,0,0]=4 423 B10R1.30 O=CC1=C(C=CC(=C1)F)O Z415638796 [2,0,0,0,0,0|1,0,0]=3 424 B10R1.30 O=CC1=C(C=CC(=C1)I)Br Z1269223795 [2,0,0,0,0,0|2,0,0]=4 425 B10R1.30 O=CC1=C(C=CC(=C1)I)Cl Z1269146293 [2,0,0,0,0,0|2,0,0]=4 426 B10R1.30 O=CC1=C(C=CC(=C1)O)Br Z1269171271 [2,0,0,0,0,0|1,0,0]=3 427 B10R1.30 O=CC1=C(C=CC(=C1)O)Cl Z1198174868 [2,0,0,0,0,0|1,0,0]=3 428 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [2,0,0,0,0,0|0,0,0]=2 429 B10R1.30 O=CC1=C(C=NC(=C1)Cl)O Z1255357850 [2,0,0,0,0,0|2,0,0]=4 430 B10R1.30 O=CC1=C(N=CC(=C1)Br)O Z1269150338 [2,0,0,0,0,0|2,0,0]=4 431 B10R1.30 OCC1=C(C=CC(=C1)Br)Cl Z415730034 [2,0,0,0,0,0|2,0,0]=4 432 B10R1.30 OCC1=C(C=CC(=C1)Br)F Z228585288 [2,0,0,0,0,0|2,0,0]=4 433 B10R1.30 OCC1=C(C=CC(=C1)Br)I Z1269238357 [2,0,0,0,0,0|2,0,0]=4 434 B10R1.30 OCC1=C(C=CC(=C1)Br)O Z56969308 [2,0,0,0,0,0|1,0,0]=3 435 B10R1.30 OCC1=C(C=CC(=C1)Cl)Cl Z397587502 [2,0,0,0,0,0|2,0,0]=4 436 B10R1.30 OCC1=C(C=CC(=C1)Cl)I Z1269213471 [2,0,0,0,0,0|2,0,0]=4 437 B10R1.30 OCC1=C(C=CC(=C1)I)Br Z1269159494 [2,0,0,0,0,0|2,0,0]=4 438 B10R1.30 OCC1=C(C=CC(=C1)I)Cl Z1269167258 [2,0,0,0,0,0|2,0,0]=4 439 B10R1.30 OCC1=C(C=CC(=C1)O)Cl Z1198184474 [2,0,0,0,0,0|1,0,0]=3 440 B12R1.75 C#CC1=C(C=CC=C1)CC(=O)N Z1262691146 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.75 CCC1=C(C=CC=C1)CC(=O)O Z1198264425 [1,1,0,0,0,0|1,0,0]=3 442 B12R1.75 COC1=C(C=CC=C1)CC(=O)N Z33545381 [1,1,0,0,0,0|1,0,0]=3 443 B12R1.75 COC1=C(C=CC=C1)CC(=O)O Z104485032 [1,1,0,0,0,0|0,0,0]=2 444 B12R1.75 COC1=C(C=CC=C1)CC(C)O Z445987128 [1,1,0,0,0,0|1,0,1]=4 445 B12R1.75 COC1=C(C=CC=C1)NC(=O)C Z27797377 [1,1,0,0,0,0|2,0,0]=4 446 B12R1.75 COC1=C(C=CC=C1)NC(=O)N Z56754689 [1,1,0,0,0,0|2,0,0]=4 447 B12R1.75 COC1=C(C=NC=C1)CC(=O)O Z2609473538 [1,1,0,0,0,0|1,0,0]=3 448 B12R1.75 CSC1=C(C=CC=C1)CC(=O)C Z1641983304 [1,1,0,0,0,0|1,1,0]=4 449 B12R1.75 CSC1=C(C=CC=C1)CC(=O)O Z1255403889 [1,1,0,0,0,0|0,1,0]=3 450 B12R1.75 NCC1=C(C=CC=C1)CC(=O)O Z1198163910 [1,1,0,0,0,0|1,0,0]=3 451 B12R1.75 O=C([O-])CC1=C(C=CC=C1)CO Z1762997367 [1,1,0,0,0,0|0,0,1]=3 452 B12R1.124 C=C(C(=O)O)C1=C(C=CC=C1)F Z1255374937 [1,1,0,0,0,0|1,0,1]=4 453 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [1,1,0,0,0,0|2,0,0]=4 454 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)Cl Z982130746 [1,1,0,0,0,0|1,0,0]=3 455 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)F Z792377276 [1,1,0,0,0,0|1,0,0]=3 456 B12R1.124 CC1=C(C=CC=C1)C(C)C(=O)O Z792377258 [1,1,0,0,0,0|1,0,0]=3 457 B12R1.124 CC1=C(C=CC=C1)C(N)C(=O)O Z317024660 [1,1,0,0,0,0|1,0,0]=3 458 B12R1.124 CC1=C(C=CN=C1)C(C)C(=O)O Z3545523789 [1,1,0,0,0,0|2,0,0]=4 459 B12R1.124 CC1=C(N=CC=C1)C(O)C(=O)O Z1945984217 [1,1,0,0,0,0|2,0,0]=4 460 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)Br Z317024716 [1,1,0,0,0,0|1,0,0]=3 461 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)F Z317024726 [1,1,0,0,0,0|1,0,0]=3 462 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)I Z2941400819 [1,1,0,0,0,0|1,0,0]=3 463 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [1,1,0,0,0,0|1,0,0]=3 464 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [1,1,0,0,0,0|1,0,0]=3 465 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [1,1,0,0,0,0|1,0,0]=3 466 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)O Z1513868900 [1,1,0,0,0,0|1,0,1]=4 467 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Br Z1269227300 [1,1,0,0,0,0|1,0,0]=3 468 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Cl Z1198264659 [1,1,0,0,0,0|1,0,0]=3 469 B12R1.224 CC1=C(C=CC=C1Br)CC(=O)O Z1269111906 [1,1,0,0,0,0|1,0,0]=3 470 B12R1.224 CC1=CC=CN(C1=O)CC(=O)O Z1096152374 [1,1,0,0,0,0|1,0,1]=4 471 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [1,1,0,0,0,0|2,0,0]=4 472 B12R1.224 NC1=C(C(=CC=C1)CC(=O)O)N Z1551954875 [1,1,0,0,0,0|1,0,0]=3 473 B12R1.224 NC1=CC=CN(C1=O)CC(=O)O Z1536942821 [1,1,0,0,0,0|1,0,1]=4 474 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)Cl Z1269150472 [1,1,0,0,0,0|1,0,0]=3 475 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)I Z1269162570 [1,1,0,0,0,0|1,0,0]=3 476 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Cl)Cl Z982129970 [1,1,0,0,0,0|1,0,0]=3 477 B12R1.224 O=C(O)CC1=C(C(=CC=C1)F)F Z445167096 [1,1,0,0,0,0|1,0,0]=3 478 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [1,1,0,0,0,0|1,0,0]=3 479 B12R1.224 O=C(O)CC1=C(C(=O)NC=C1)Br Z1889916989 [1,1,0,0,0,0|2,0,0]=4 480 B12R1.224 O=C(O)CN1C=CC=C(C1=O)O Z1262513138 [1,1,0,0,0,0|1,0,1]=4 481 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [1,1,0,0,0,0|2,0,0]=4 482 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [1,1,0,0,0,0|2,0,0]=4 483 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [1,1,0,0,0,0|2,0,0]=4 484 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)O Z33451994 [1,1,0,0,0,0|2,0,0]=4 485 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [1,1,0,0,0,0|2,0,0]=4 486 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O Z1269213926 [1,1,0,0,0,0|1,0,0]=3 487 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O Z982130478 [1,1,0,0,0,0|1,0,0]=3 488 B12R1.233 CC1=C(C=CC(=N1)Cl)CC(=O)O Z1198264658 [1,1,0,0,0,0|2,0,0]=4 489 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br Z1269232519 [1,1,0,0,0,0|1,0,0]=3 490 B12R1.233 CC1=CC(=O)C=CN1CC(=O)O Z1262520984 [1,1,0,0,0,0|2,0,0]=4 491 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [1,1,0,0,0,0|2,0,0]=4 492 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)F Z1198183551 [1,1,0,0,0,0|1,0,0]=3 493 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl Z1269137680 [1,1,0,0,0,0|1,0,0]=3 494 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I Z1269231484 [1,1,0,0,0,0|1,0,0]=3 495 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O Z1269204929 [1,1,0,0,0,0|0,0,0]=2 496 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br Z1187934893 [1,1,0,0,0,0|1,0,0]=3 497 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl Z104477206 [1,1,0,0,0,0|1,0,0]=3 498 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br Z285184632 [1,1,0,0,0,0|1,0,0]=3 499 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Cl Z285184620 [1,1,0,0,0,0|1,0,0]=3 500 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F Z362118706 [1,1,0,0,0,0|1,0,0]=3 501 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [1,1,0,0,0,0|1,0,0]=3 502 B12R1.233 O=C(O)CC1=C(C=C(C=N1)F)F Z1198264626 [1,1,0,0,0,0|2,0,0]=4 503 B12R1.233 O=C(O)CN1C=CC(=CC1=O)Br Z2689726361 [1,1,0,0,0,0|1,0,1]=4 504 B12R1.371 CC1=C(C=CC=C1)NC(=O)CO Z228585408 [1,1,0,0,0,0|2,0,0]=4 505 B12R1.371 CCC(=O)CC1=C(C=CC=C1)Br Z513735296 [1,1,0,0,0,0|2,0,0]=4 506 B12R1.371 CCC(=O)NC1=C(C=CC=C1)O Z68195027 [1,1,0,0,0,0|2,0,0]=4 507 B12R1.371 CNC(=O)CC1=C(C=CC=C1)N Z234895127 [1,1,0,0,0,0|2,0,0]=4 508 B12R1.371 COC(=O)CC1=C(C=CC=C1)Cl Z24820310 [1,1,0,0,0,0|1,0,0]=3 509 B12R1.371 COC(=O)CC1=C(C=CC=C1)I Z1269173309 [1,1,0,0,0,0|1,0,0]=3 510 B12R1.371 COC(=O)CC1=C(C=CC=C1)N Z1333043515 [1,1,0,0,0,0|1,0,0]=3 511 B12R1.371 COC(=O)CC1=C(C=CC=C1)O Z1010319062 [1,1,0,0,0,0|0,0,0]=2 512 B12R1.371 COC(=O)NC1=C(C=CC=C1)O Z425822036 [1,1,0,0,0,0|1,0,0]=3 513 B12R1.371 N/C(=N\O)/CC1=C(C=CC=C1)Cl Z451350216 [1,1,0,0,0,0|2,0,0]=4 514 B12R1.371 O=C(CC1=C(C=CC=C1)Cl)NO Z59182782 [1,1,0,0,0,0|1,0,0]=3 515 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Br Z408178456 [1,1,0,0,0,0|2,0,0]=4 516 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Cl Z408178450 [1,1,0,0,0,0|2,0,0]=4 517 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)F Z316174764 [1,1,0,0,0,0|2,0,0]=4 518 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)O Z57764509 [1,1,0,0,0,0|2,0,0]=4 519 B12R1.1009 CC(=O)CC1=C(C=CC=C1Cl)Cl Z858029228 [1,1,0,0,0,0|2,0,0]=4 520 B12R1.1009 CC1=C(C(=CC=C1)Cl)CC(=O)O Z1255430731 [1,1,0,0,0,0|1,0,0]=3 521 B12R1.1009 CC1=C(C(=CC=C1)F)CC(=O)O Z1255489762 [1,1,0,0,0,0|1,0,0]=3 522 B12R1.1009 CC1=CC=CC(=C1CC(=O)O)C Z1198167156 [1,1,0,0,0,0|1,0,0]=3 523 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl Z33546774 [1,1,0,0,0,0|2,0,0]=4 524 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)Cl Z33546661 [1,1,0,0,0,0|2,0,0]=4 525 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)F Z1389112660 [1,1,0,0,0,0|2,0,0]=4 526 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Br Z1551916621 [1,1,0,0,0,0|1,0,0]=3 527 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Cl Z104478552 [1,1,0,0,0,0|1,0,0]=3 528 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)Cl Z57044264 [1,1,0,0,0,0|1,0,0]=3 529 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)F Z362118786 [1,1,0,0,0,0|1,0,0]=3 530 B12R1.1009 O=C(O)CC1=C(C=NC=C1F)Cl Z1255367200 [1,1,0,0,0,0|2,0,0]=4 531 B12R1.1009 O=C(O)CC1=C(N=CN=C1O)O Z1258932597 [1,1,0,0,0,0|2,0,0]=4 532 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [1,1,0,0,0,0|2,0,0]=4 533 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [1,1,0,0,0,0|2,0,0]=4 534 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Br Z1269160930 [1,1,0,0,0,0|1,0,0]=3 535 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)C Z56923286 [1,1,0,0,0,0|1,0,0]=3 536 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [1,1,0,0,0,0|1,0,0]=3 537 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [1,1,0,0,0,0|0,0,0]=2 538 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)Br Z1269233833 [1,1,0,0,0,0|1,0,0]=3 539 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [1,1,0,0,0,0|1,0,0]=3 540 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl Z2677377810 [1,1,0,0,0,0|2,0,0]=4 541 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [1,1,0,0,0,0|2,0,0]=4 542 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Br Z1269150510 [1,1,0,0,0,0|1,0,0]=3 543 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [1,1,0,0,0,0|1,0,0]=3 544 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)F Z1269111454 [1,1,0,0,0,0|1,0,0]=3 545 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [1,1,0,0,0,0|1,0,0]=3 546 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [1,1,0,0,0,0|1,0,0]=3 547 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Br Z285131564 [1,1,0,0,0,0|1,0,0]=3 548 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [1,1,0,0,0,0|1,0,0]=3 549 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)F Z362118708 [1,1,0,0,0,0|1,0,0]=3 550 B12R1.19 O=C(O)CC1=CC(=C(C=C1)I)Br Z1269147843 [1,1,0,0,0,0|1,0,0]=3 551 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [1,1,0,0,0,0|1,0,0]=3 552 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [1,1,0,0,0,0|1,0,0]=3 553 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [1,1,0,0,0,0|0,0,0]=2 554 B12R1.50 CC1=CC(=CC=C1)CC(=O)CCl Z276118998 [1,1,0,0,0,0|2,0,0]=4 555 B12R1.50 CC1=CC(=CC=C1)NC(=O)CO Z431952658 [1,1,0,0,0,0|2,0,0]=4 556 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [1,1,0,0,0,0|1,0,0]=3 557 B12R1.50 CNC(=O)OC1=CC(=CC=C1)O Z1509352023 [1,1,0,0,0,0|2,0,0]=4 558 B12R1.50 COC(=O)CC1=CC(=CC=C1)Br Z905185712 [1,1,0,0,0,0|1,0,0]=3 559 B12R1.50 COC(=O)CC1=CC(=CC=C1)N Z1250132316 [1,1,0,0,0,0|1,0,0]=3 560 B12R1.50 COC(=O)CC1=CC(=CC=C1)O Z816010254 [1,1,0,0,0,0|0,0,0]=2 561 B12R1.50 COC(=O)CC1=CC(=CN=C1)Br Z1269220704 [1,1,0,0,0,0|2,0,0]=4 562 B12R1.50 COC(=O)NC1=CC(=CC=C1)C Z371333120 [1,1,0,0,0,0|2,0,0]=4 563 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl Z56754690 [1,1,0,0,0,0|2,0,0]=4 564 B12R1.50 COC(=O)NC1=CC(=CC=C1)N Z319610162 [1,1,0,0,0,0|2,0,0]=4 565 B12R1.50 COC(=O)NC1=CC(=CC=C1)O Z335810160 [1,1,0,0,0,0|1,0,0]=3 566 B12R1.50 NC1=CC(=CC=C1)NC(=O)CO Z385458324 [1,1,0,0,0,0|2,0,0]=4 567 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [1,1,0,0,0,0|2,0,0]=4 568 B12R1.50 O=C(CC1=CC(=CC=C1)F)NO Z59182830 [1,1,0,0,0,0|1,0,0]=3 569 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [1,1,0,0,0,0|0,0,0]=2 570 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Br Z408178442 [1,1,0,0,0,0|2,0,0]=4 571 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Cl Z316174772 [1,1,0,0,0,0|2,0,0]=4 572 B12R1.50 O=C(CCl)CC1=CC=CC(=C1)F Z316174766 [1,1,0,0,0,0|2,0,0]=4 573 B12R1.101 CC1=CC(=CC(=C1)CC(=O)O)C Z274447882 [1,1,0,0,0,0|1,0,0]=3 574 B12R1.101 NC1=CC(=CC(=C1)Br)CC(=O)O Z2732612288 [1,1,0,0,0,0|1,0,0]=3 575 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Cl)Cl Z1269159102 [1,1,0,0,0,0|1,0,0]=3 576 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)Br Z1269139128 [1,1,0,0,0,0|1,0,0]=3 577 B12R1.101 O=C(O)CC1=CC(=CC(=C1)I)I Z1269132492 [1,1,0,0,0,0|1,0,0]=3 578 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)Br Z1269195529 [1,1,0,0,0,0|0,0,0]=2 579 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [1,1,0,0,0,0|2,0,0]=4 580 B12R1.225 CC(C(=O)O)C1=CC(=CC=C1)F Z792377330 [1,1,0,0,0,0|1,0,0]=3 581 B12R1.225 CC1=CC(=CC=C1)C(=O)C(=O)O Z1255379743 [1,1,0,0,0,0|1,0,1]=4 582 B12R1.225 CC1=CC(=CC=C1)C(N)C(=O)O Z317024596 [1,1,0,0,0,0|1,0,0]=3 583 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [1,1,0,0,0,0|1,0,0]=3 584 B12R1.225 CC1=CC=CC(=C1)C(C)C(=O)O Z802854000 [1,1,0,0,0,0|1,0,0]=3 585 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [1,1,0,0,0,0|2,0,0]=4 586 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Br Z317024672 [1,1,0,0,0,0|1,0,0]=3 587 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Cl Z317024654 [1,1,0,0,0,0|1,0,0]=3 588 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)F Z317024592 [1,1,0,0,0,0|1,0,0]=3 589 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)I Z3477438782 [1,1,0,0,0,0|1,0,0]=3 590 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [1,1,0,0,0,0|0,0,0]=2 591 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [1,1,0,0,0,0|1,0,0]=3 592 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [1,1,0,0,0,0|1,0,0]=3 593 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [1,1,0,0,0,0|1,0,0]=3 594 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [1,1,0,0,0,0|1,0,0]=3 595 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [1,1,0,0,0,0|1,0,0]=3 596 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [1,1,0,0,0,0|2,0,0]=4 597 B12R1.438 CCC1=CC(=CC=C1)CC(=O)O Z1198264513 [1,1,0,0,0,0|1,0,0]=3 598 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [1,1,0,0,0,0|2,0,0]=4 599 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [1,1,0,0,0,0|1,0,0]=3 600 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [1,1,0,0,0,0|0,0,0]=2 601 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [1,1,0,0,0,0|2,0,0]=4 602 B12R1.438 COC1=NC=CC(=C1)CC(=O)O Z2186882871 [1,1,0,0,0,0|1,0,0]=3 603 B12R1.438 N#CC1=CC=CC(=C1)CC(=O)O Z982130150 [1,1,0,0,0,0|1,0,0]=3 604 B12R1.438 N#CC1=CN=CC(=C1)CC(=O)O Z1255398377 [1,1,0,0,0,0|2,0,0]=4 605 B12R1.438 O=CC1=CC=CC(=C1)CC(=O)O Z1262512246 [1,1,0,0,0,0|0,0,1]=3 606 B12R1.270 C=CCC1=C(C=CC(=C1)C=O)O Z57842085 [1,1,0,0,0,0|1,0,1]=4 607 B12R1.270 C=CCC1=C(C=CC(=C1)OC)O Z57046211 [1,1,0,0,0,0|1,0,0]=3 608 B12R1.46 CC1=CC(=C(C=C1)C=O)C(=O)O Z1262549641 [0,1,0,0,1,0|1,0,1]=4 609 B12R1.46 CCC1=C(C=C(C=C1)Br)C(=O)O Z1269239111 [0,1,0,0,1,0|2,0,0]=4 610 B12R1.46 CCC1=C(C=C(C=C1)C)C(=O)O Z1551918805 [0,1,0,0,1,0|2,0,0]=4 611 B12R1.46 CCC1=C(C=C(C=C1)F)C(=O)O Z1255427041 [0,1,0,0,1,0|2,0,0]=4 612 B12R1.46 CNC1=C(C=C(C=C1)Cl)C(=O)O Z111833878 [0,1,0,0,1,0|2,0,0]=4 613 B12R1.46 CNC1=C(C=C(C=C1)F)C(=O)O Z1080487080 [0,1,0,0,1,0|2,0,0]=4 614 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)O Z57915930 [0,1,0,0,1,0|1,0,0]=3 615 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)C Z104508102 [0,1,0,0,1,0|2,0,0]=4 616 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)N Z101185922 [0,1,0,0,1,0|2,0,0]=4 617 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)O Z94601371 [0,1,0,0,1,0|1,0,0]=3 618 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)C Z54601467 [0,1,0,0,1,0|2,0,0]=4 619 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)O Z104480402 [0,1,0,0,1,0|1,0,0]=3 620 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)C Z54601918 [0,1,0,0,1,0|2,0,0]=4 621 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)O Z234894074 [0,1,0,0,1,0|1,0,0]=3 622 B12R1.46 COC1=C(C=C(C=C1)N)C(=O)O Z2327883809 [0,1,0,0,1,0|1,0,0]=3 623 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)C Z1198163904 [0,1,0,0,1,0|1,0,0]=3 624 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)O Z1198279013 [0,1,0,0,1,0|0,0,0]=2 625 B12R1.46 COC1=C(C=C(C=C1)O)[N+](=O)[O-] Z1201617635 [0,1,0,0,1,0|1,0,1]=4 626 B12R1.46 COC1=C(C=C(C=N1)F)C(=O)O Z1198165238 [0,1,0,0,1,0|2,0,0]=4 627 B12R1.46 CSC1=C(C=C(C=C1)Br)C(=O)O Z1269196188 [0,1,0,0,1,0|1,1,0]=4 628 B12R1.46 CSC1=C(C=C(C=C1)N)C(=O)O Z732208930 [0,1,0,0,1,0|1,1,0]=4 629 B12R1.46 O=CC1=C(C=C(C=C1)Br)C(=O)O Z1269149480 [0,1,0,0,1,0|1,0,1]=4 630 B12R1.46 O=CC1=C(C=C(C=C1)Cl)C(=O)O Z1198170017 [0,1,0,0,1,0|1,0,1]=4 631 B12R1.46 O=CC1=C(C=C(C=C1)F)C(=O)O Z1198309556 [0,1,0,0,1,0|1,0,1]=4 632 B12R1.128 CC1=CC(=C(C=C1)O)S(=O)(=O)O Z1513803805 [0,1,0,0,1,0|2,0,0]=4 633 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Br)F)O Z1269206113 [0,1,0,0,1,0|2,0,0]=4 634 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)Br)O Z1269152570 [0,1,0,0,1,0|2,0,0]=4 635 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)C)O Z57784029 [0,1,0,0,1,0|2,0,0]=4 636 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)C)O Z57789902 [0,1,0,0,1,0|2,0,0]=4 637 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)Cl)O Z1269151638 [0,1,0,0,1,0|2,0,0]=4 638 B12R1.232 CC(=O)C1=C(C=C(C(=C1)F)Br)O Z1269151731 [0,1,0,0,1,0|2,0,0]=4 639 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)F)F Z2310996536 [0,1,0,0,1,0|2,0,0]=4 640 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)O)O Z274502124 [0,1,0,0,1,0|1,0,0]=3 641 B12R1.232 CC1=C(C=C(C(=C1)Br)C(=O)O)Br Z1269220185 [0,1,0,0,1,0|2,0,0]=4 642 B12R1.232 CC1=C(C=C(C(=C1)Br)C(=O)O)Cl Z1993723520 [0,1,0,0,1,0|2,0,0]=4 643 B12R1.232 CC1=C(C=C(C(=C1)Br)C(=O)O)N Z1269183101 [0,1,0,0,1,0|2,0,0]=4 644 B12R1.232 CC1=C(C=C(C(=C1)Br)Cl)C(=O)O Z1269169301 [0,1,0,0,1,0|2,0,0]=4 645 B12R1.232 CC1=C(C=C(C(=C1)Br)F)C(=O)O Z1269219899 [0,1,0,0,1,0|2,0,0]=4 646 B12R1.232 CC1=C(C=C(C(=C1)Br)N)C(=O)O Z1618024390 [0,1,0,0,1,0|2,0,0]=4 647 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)Cl)Cl Z1258905398 [0,1,0,0,1,0|2,0,0]=4 648 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)Cl)F Z1262556078 [0,1,0,0,1,0|2,0,0]=4 649 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)Cl)N Z1416158395 [0,1,0,0,1,0|2,0,0]=4 650 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)F)Cl Z1262560000 [0,1,0,0,1,0|2,0,0]=4 651 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)F)F Z1198233559 [0,1,0,0,1,0|2,0,0]=4 652 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)F)N Z3303679359 [0,1,0,0,1,0|2,0,0]=4 653 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)I)Cl Z1681355647 [0,1,0,0,1,0|2,0,0]=4 654 B12R1.232 CC1=C(C=C(C(=C1)C(=O)O)N)F Z1262528076 [0,1,0,0,1,0|2,0,0]=4 655 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(=O)O)Br Z1888356777 [0,1,0,0,1,0|2,0,0]=4 656 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(=O)O)C Z1201628893 [0,1,0,0,1,0|2,0,0]=4 657 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(=O)O)F Z1255402558 [0,1,0,0,1,0|2,0,0]=4 658 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(=O)O)N Z1262538437 [0,1,0,0,1,0|2,0,0]=4 659 B12R1.232 CC1=C(C=C(C(=C1)Cl)Cl)C(=O)O Z1509028747 [0,1,0,0,1,0|2,0,0]=4 660 B12R1.232 CC1=C(C=C(C(=C1)F)C(=O)O)Br Z1450923293 [0,1,0,0,1,0|2,0,0]=4 661 B12R1.232 CC1=C(C=C(C(=C1)F)C(=O)O)F Z1198176150 [0,1,0,0,1,0|2,0,0]=4 662 B12R1.232 CC1=C(C=C(C(=C1)F)Cl)C(=O)O Z1650054506 [0,1,0,0,1,0|2,0,0]=4 663 B12R1.232 CC1=C(C=C(C(=C1)F)N)C(=O)O Z1262556754 [0,1,0,0,1,0|2,0,0]=4 664 B12R1.232 CC1=C(C=C(C(=C1)N)Br)C(=O)O Z1614605433 [0,1,0,0,1,0|2,0,0]=4 665 B12R1.232 CC1=C(C=C(C(=C1)N)C(=O)O)C Z1198151442 [0,1,0,0,1,0|2,0,0]=4 666 B12R1.232 CC1=C(C=C(C(=C1)O)C(=O)O)Br Z1269111606 [0,1,0,0,1,0|1,0,0]=3 667 B12R1.232 CC1=C(C=C(C(=C1)O)O)C(=O)O Z1255427529 [0,1,0,0,1,0|1,0,0]=3 668 B12R1.232 CC1=CC(=C(C=C1C(=O)O)Br)C Z1450923143 [0,1,0,0,1,0|2,0,0]=4 669 B12R1.232 CC1=CC(=C(C=C1C(=O)O)C)Br Z1203658888 [0,1,0,0,1,0|2,0,0]=4 670 B12R1.232 CC1=CC(=C(C=C1C(=O)O)C)C Z1255438674 [0,1,0,0,1,0|2,0,0]=4 671 B12R1.232 CC1=CC(=C(C=C1C(=O)O)C)Cl Z1201625877 [0,1,0,0,1,0|2,0,0]=4 672 B12R1.232 CC1=CC(=C(C=C1C(=O)O)I)C Z1269218402 [0,1,0,0,1,0|2,0,0]=4 673 B12R1.232 CC1=CC(=C(C=C1C(=O)O)N)C Z954595614 [0,1,0,0,1,0|2,0,0]=4 674 B12R1.232 NC1=C(C=C(C(=C1)Br)Br)C(=O)O Z89264939 [0,1,0,0,1,0|2,0,0]=4 675 B12R1.232 NC1=C(C=C(C(=C1)Br)F)C(=O)O Z1269239383 [0,1,0,0,1,0|2,0,0]=4 676 B12R1.232 NC1=C(C=C(C(=C1)C(=O)O)Br)Cl Z1269171992 [0,1,0,0,1,0|2,0,0]=4 677 B12R1.232 NC1=C(C=C(C(=C1)C(=O)O)F)F Z425453002 [0,1,0,0,1,0|2,0,0]=4 678 B12R1.232 NC1=C(C=C(C(=C1)Cl)Cl)C(=O)O Z1269194034 [0,1,0,0,1,0|2,0,0]=4 679 B12R1.232 NC1=C(C=C(C(=C1)Cl)I)C(=O)O Z1681336195 [0,1,0,0,1,0|2,0,0]=4 680 B12R1.232 NC1=C(C=C(C(=C1)F)Br)C(=O)O Z1029457826 [0,1,0,0,1,0|2,0,0]=4 681 B12R1.232 NC1=C(C=C(C(=C1)F)C(=O)O)Cl Z1262559064 [0,1,0,0,1,0|2,0,0]=4 682 B12R1.232 NC1=C(C=C(C(=C1)F)C(=O)O)F Z1198167170 [0,1,0,0,1,0|2,0,0]=4 683 B12R1.232 NC1=C(C=C(C(=C1)F)C(=O)O)N Z1255359006 [0,1,0,0,1,0|2,0,0]=4 684 B12R1.232 NC1=C(C=C(C(=C1)F)Cl)C(=O)O Z1198234893 [0,1,0,0,1,0|2,0,0]=4 685 B12R1.232 NC1=C(C=C(C(=C1)F)F)C(=O)O Z362758702 [0,1,0,0,1,0|2,0,0]=4 686 B12R1.232 NC1=C(C=C(C(=C1)F)O)C(=O)O Z905174978 [0,1,0,0,1,0|1,0,0]=3 687 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)F)Cl Z1450923101 [0,1,0,0,1,0|2,0,0]=4 688 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)F)F Z1269207518 [0,1,0,0,1,0|2,0,0]=4 689 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)F)I Z1450923043 [0,1,0,0,1,0|2,0,0]=4 690 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)F)O Z1269213699 [0,1,0,0,1,0|1,0,0]=3 691 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)O)F Z1939443092 [0,1,0,0,1,0|2,0,0]=4 692 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)Br)F Z1269228274 [0,1,0,0,1,0|2,0,0]=4 693 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)Br Z1450943879 [0,1,0,0,1,0|2,0,0]=4 694 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)Cl Z1450943901 [0,1,0,0,1,0|2,0,0]=4 695 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)I Z1450943854 [0,1,0,0,1,0|2,0,0]=4 696 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)F)O Z1262517120 [0,1,0,0,1,0|1,0,0]=3 697 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Cl)I)F Z3325789422 [0,1,0,0,1,0|2,0,0]=4 698 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Br)Cl Z1269235353 [0,1,0,0,1,0|2,0,0]=4 699 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Br)F Z1203660652 [0,1,0,0,1,0|2,0,0]=4 700 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Br)O Z1726073409 [0,1,0,0,1,0|1,0,0]=3 701 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Cl)Cl Z104509126 [0,1,0,0,1,0|2,0,0]=4 702 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)Cl)F Z1203161787 [0,1,0,0,1,0|2,0,0]=4 703 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)F)Br Z1269235585 [0,1,0,0,1,0|2,0,0]=4 704 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)F)Cl Z104476586 [0,1,0,0,1,0|2,0,0]=4 705 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)F)F Z1203162173 [0,1,0,0,1,0|2,0,0]=4 706 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)F)I Z1029452572 [0,1,0,0,1,0|2,0,0]=4 707 B12R1.232 O=C(O)C1=C(C=C(C(=C1)F)F)O Z1255417211 [0,1,0,0,1,0|1,0,0]=3 708 B12R1.232 O=C(O)C1=C(C=C(C(=C1)I)Cl)Cl Z1450923128 [0,1,0,0,1,0|2,0,0]=4 709 B12R1.232 O=C(O)C1=C(C=C(C(=C1)I)F)F Z1269228563 [0,1,0,0,1,0|2,0,0]=4 710 B12R1.453 CC1=C(C=C(C=C1)C#N)C(=O)O Z1255495726 [0,1,0,0,1,0|2,0,0]=4 711 B12R1.453 CC1=C(C=C(C=C1)C=O)C(=O)O Z1813092023 [0,1,0,0,1,0|1,0,1]=4 712 B12R1.453 CCC1=CC(=C(C=C1)C)C(=O)O Z1262538890 [0,1,0,0,1,0|2,0,0]=4 713 B12R1.453 CCC1=CC(=C(C=C1)Cl)C(=O)O Z1201628894 [0,1,0,0,1,0|2,0,0]=4 714 B12R1.453 CCC1=CC(=C(C=C1)F)C(=O)O Z1255442013 [0,1,0,0,1,0|2,0,0]=4 715 B12R1.453 CCC1=CC(=C(C=C1)N)C(=O)O Z362758706 [0,1,0,0,1,0|2,0,0]=4 716 B12R1.453 CCC1=CC(=C(C=C1)O)C(=O)O Z367679272 [0,1,0,0,1,0|1,0,0]=3 717 B12R1.453 CNC1=CC(=C(C=C1)Cl)C(=O)O Z2130643804 [0,1,0,0,1,0|2,0,0]=4 718 B12R1.453 COC1=CC(=C(C=C1)Br)C(=O)N Z33545388 [0,1,0,0,1,0|2,0,0]=4 719 B12R1.453 COC1=CC(=C(C=C1)Br)C(=O)O Z104487486 [0,1,0,0,1,0|1,0,0]=3 720 B12R1.453 COC1=CC(=C(C=C1)Cl)C(=O)O Z1201620273 [0,1,0,0,1,0|1,0,0]=3 721 B12R1.453 COC1=CC(=C(C=C1)N)C(=O)O Z594219052 [0,1,0,0,1,0|1,0,0]=3 722 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)C Z104483744 [0,1,0,0,1,0|1,0,0]=3 723 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)N Z394696298 [0,1,0,0,1,0|1,0,0]=3 724 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)O Z104495362 [0,1,0,0,1,0|0,0,0]=2 725 B12R1.453 COC1=NC(=C(C=C1)C)C(=O)O Z1255390077 [0,1,0,0,1,0|2,0,0]=4 726 B12R1.453 COC1=NC(=C(C=C1)Cl)C(=O)O Z221432352 [0,1,0,0,1,0|2,0,0]=4 727 B12R1.453 COC1=NC(=C(C=C1)F)C(=O)O Z1255447688 [0,1,0,0,1,0|2,0,0]=4 728 B12R1.453 CSC1=CC(=C(C=C1)C)C(=O)O Z255150402 [0,1,0,0,1,0|1,1,0]=4 729 B12R1.453 CSC1=CC(=C(C=C1)Cl)C(=O)O Z104495540 [0,1,0,0,1,0|1,1,0]=4 730 B12R1.453 CSC1=CC(=C(C=C1)O)C(=O)O Z1255431342 [0,1,0,0,1,0|0,1,0]=3 731 B12R1.453 N#CC1=CC(=C(C=C1)Br)C(=O)O Z1269112120 [0,1,0,0,1,0|2,0,0]=4 732 B12R1.453 N#CC1=CC(=C(C=C1)Cl)C(=O)O Z1198304567 [0,1,0,0,1,0|2,0,0]=4 733 B12R1.453 N#CC1=CC(=C(C=C1)F)C(=O)O Z1255461823 [0,1,0,0,1,0|2,0,0]=4 734 B12R1.453 N#CC1=CC(=C(C=C1)N)C(=O)O Z1262514273 [0,1,0,0,1,0|2,0,0]=4 735 B12R1.453 N#CC1=CC(=C(C=C1)O)C(=O)O Z1255393347 [0,1,0,0,1,0|1,0,0]=3 736 B12R1.453 NNC1=CC(=C(C=C1)Cl)C(=O)O Z56792408 [0,1,0,0,1,0|2,0,0]=4 737 B12R1.453 O=C(O)C1=C(C=CC(=C1)CO)Cl Z1262523857 [0,1,0,0,1,0|1,0,0]=3 738 B12R1.453 O=CC1=CC(=C(C=C1)F)C(=O)O Z1201623086 [0,1,0,0,1,0|1,0,1]=4 739 B12R1.453 O=CC1=CC(=C(C=C1)O)C(=O)O Z1255430994 [0,1,0,0,1,0|0,0,1]=3 740 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Br)Br)O Z104500096 [0,1,0,0,1,0|2,0,0]=4 741 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Br)C)O Z1098334204 [0,1,0,0,1,0|2,0,0]=4 742 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Br)Cl)O Z979488348 [0,1,0,0,1,0|2,0,0]=4 743 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Br)F)O Z979488342 [0,1,0,0,1,0|2,0,0]=4 744 B12R1.511 CC(=O)C1=C(C(=CC(=C1)C)Br)O Z979488360 [0,1,0,0,1,0|2,0,0]=4 745 B12R1.511 CC(=O)C1=C(C(=CC(=C1)C)Cl)O Z1513808674 [0,1,0,0,1,0|2,0,0]=4 746 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Cl)C)O Z979488366 [0,1,0,0,1,0|2,0,0]=4 747 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Cl)Cl)O Z56858262 [0,1,0,0,1,0|2,0,0]=4 748 B12R1.511 CC(=O)C1=C(C(=CC(=C1)F)Br)O Z979488384 [0,1,0,0,1,0|2,0,0]=4 749 B12R1.511 CC(=O)C1=C(C(=CC(=C1)F)F)O Z979488388 [0,1,0,0,1,0|2,0,0]=4 750 B12R1.511 CC1=C(C(=CC(=C1)Br)C(=O)O)C Z1450923157 [0,1,0,0,1,0|2,0,0]=4 751 B12R1.511 CC1=C(C(=CC(=C1)Br)C(=O)O)F Z1456329762 [0,1,0,0,1,0|2,0,0]=4 752 B12R1.511 CC1=C(C(=CC(=C1)Br)C(=O)O)N Z362758812 [0,1,0,0,1,0|2,0,0]=4 753 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)C Z1262523452 [0,1,0,0,1,0|2,0,0]=4 754 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)N Z362758746 [0,1,0,0,1,0|2,0,0]=4 755 B12R1.511 CC1=C(C(=CC(=C1)Cl)C(=O)O)O Z367679262 [0,1,0,0,1,0|1,0,0]=3 756 B12R1.511 CC1=C(C(=CC(=C1)F)C(=O)O)C Z1681382150 [0,1,0,0,1,0|2,0,0]=4 757 B12R1.511 CC1=C(C(=CC(=C1)F)C(=O)O)I Z3210509262 [0,1,0,0,1,0|2,0,0]=4 758 B12R1.511 CC1=C(C(=CC(=C1)F)C(=O)O)N Z362758804 [0,1,0,0,1,0|2,0,0]=4 759 B12R1.511 CC1=C(C(=CC(=C1)I)C(=O)O)C Z1079170156 [0,1,0,0,1,0|2,0,0]=4 760 B12R1.511 CC1=C(C=C(C=C1Br)F)C(=O)O Z1269230956 [0,1,0,0,1,0|2,0,0]=4 761 B12R1.511 CC1=C(C=C(C=C1Br)I)C(=O)O Z1322794947 [0,1,0,0,1,0|2,0,0]=4 762 B12R1.511 CC1=C(C=C(C=C1Br)N)C(=O)O Z1263879405 [0,1,0,0,1,0|2,0,0]=4 763 B12R1.511 CC1=C(C=C(C=C1Cl)Br)C(=O)O Z1450944023 [0,1,0,0,1,0|2,0,0]=4 764 B12R1.511 CC1=C(C=C(C=C1I)Br)C(=O)O Z1322794503 [0,1,0,0,1,0|2,0,0]=4 765 B12R1.511 CC1=C(C=C(C=C1N)Br)C(=O)O Z1259106644 [0,1,0,0,1,0|2,0,0]=4 766 B12R1.511 CC1=C(C=C(C=C1N)F)C(=O)O Z1696822297 [0,1,0,0,1,0|2,0,0]=4 767 B12R1.511 CC1=C(C=C(C=C1N)O)C(=O)O Z3379440530 [0,1,0,0,1,0|1,0,0]=3 768 B12R1.511 CC1=CC(=C(C(=C1)Br)Br)C(=O)O Z1450923299 [0,1,0,0,1,0|2,0,0]=4 769 B12R1.511 CC1=CC(=C(C(=C1)Br)F)C(=O)O Z1269236408 [0,1,0,0,1,0|2,0,0]=4 770 B12R1.511 CC1=CC(=C(C(=C1)Br)N)C(=O)O Z111833898 [0,1,0,0,1,0|2,0,0]=4 771 B12R1.511 CC1=CC(=C(C(=C1)Br)O)C(=O)N Z1382727110 [0,1,0,0,1,0|2,0,0]=4 772 B12R1.511 CC1=CC(=C(C(=C1)Br)O)C(=O)O Z367679390 [0,1,0,0,1,0|1,0,0]=3 773 B12R1.511 CC1=CC(=C(C(=C1)C)Br)C(=O)O Z1450943407 [0,1,0,0,1,0|2,0,0]=4 774 B12R1.511 CC1=CC(=C(C(=C1)C)C)C(=O)O Z1262510849 [0,1,0,0,1,0|2,0,0]=4 775 B12R1.511 CC1=CC(=C(C(=C1)C)N)C(=O)O Z362758732 [0,1,0,0,1,0|2,0,0]=4 776 B12R1.511 CC1=CC(=C(C(=C1)C)O)C(=O)O Z367679358 [0,1,0,0,1,0|1,0,0]=3 777 B12R1.511 CC1=CC(=C(C(=C1)Cl)Br)C(=O)O Z1450944061 [0,1,0,0,1,0|2,0,0]=4 778 B12R1.511 CC1=CC(=C(C(=C1)Cl)N)C(=O)O Z362758754 [0,1,0,0,1,0|2,0,0]=4 779 B12R1.511 CC1=CC(=C(C(=C1)F)N)C(=O)O Z362758782 [0,1,0,0,1,0|2,0,0]=4 780 B12R1.511 CC1=CC(=C(C(=C1)I)O)C(=O)O Z2787468595 [0,1,0,0,1,0|1,0,0]=3 781 B12R1.511 CC1=NC(=C(C(=C1)C(=O)O)O)C Z1216824353 [0,1,0,0,1,0|2,0,0]=4 782 B12R1.511 NC(=O)C1=C(C(=CC(=C1)Cl)Br)O Z1382725487 [0,1,0,0,1,0|2,0,0]=4 783 B12R1.511 NC1=C(C(=CC(=C1)Br)C(=O)O)N Z1269177754 [0,1,0,0,1,0|2,0,0]=4 784 B12R1.511 NC1=C(C(=CC(=C1)Cl)C(=O)O)F Z1079174618 [0,1,0,0,1,0|2,0,0]=4 785 B12R1.511 NC1=C(C(=CC(=C1)F)C(=O)O)F Z1079174562 [0,1,0,0,1,0|2,0,0]=4 786 B12R1.511 NC1=C(C(=CC(=C1)O)C(=O)O)Br Z3045674186 [0,1,0,0,1,0|1,0,0]=3 787 B12R1.511 NC1=C(C(=CC(=C1)O)C(=O)O)Cl Z2180969350 [0,1,0,0,1,0|1,0,0]=3 788 B12R1.511 NC1=C(C=C(C=C1Br)Br)C(=O)O Z104508440 [0,1,0,0,1,0|2,0,0]=4 789 B12R1.511 NC1=C(C=C(C=C1Br)Cl)C(=O)O Z1222394694 [0,1,0,0,1,0|2,0,0]=4 790 B12R1.511 NC1=C(C=C(C=C1Br)F)C(=O)O Z362758820 [0,1,0,0,1,0|2,0,0]=4 791 B12R1.511 NC1=C(C=C(C=C1Cl)Br)C(=O)O Z362758802 [0,1,0,0,1,0|2,0,0]=4 792 B12R1.511 NC1=C(C=C(C=C1Cl)Cl)C(=O)O Z56788599 [0,1,0,0,1,0|2,0,0]=4 793 B12R1.511 NC1=C(C=C(C=C1Cl)F)C(=O)O Z362758766 [0,1,0,0,1,0|2,0,0]=4 794 B12R1.511 NC1=C(C=C(C=C1F)Br)C(=O)O Z362758764 [0,1,0,0,1,0|2,0,0]=4 795 B12R1.511 NC1=C(C=C(C=C1F)Cl)C(=O)O Z362758770 [0,1,0,0,1,0|2,0,0]=4 796 B12R1.511 NC1=C(C=C(C=C1F)F)C(=O)O Z362758760 [0,1,0,0,1,0|2,0,0]=4 797 B12R1.511 NC1=C(C=C(C=C1F)I)C(=O)O Z1416158392 [0,1,0,0,1,0|2,0,0]=4 798 B12R1.511 NC1=C(C=C(C=C1I)F)C(=O)O Z1365432426 [0,1,0,0,1,0|2,0,0]=4 799 B12R1.511 NC1=CC(=C(C(=C1)Br)O)C(=O)O Z1269188914 [0,1,0,0,1,0|1,0,0]=3 800 B12R1.511 NC1=CC(=C(C(=C1)Cl)Cl)C(=O)O Z1079174590 [0,1,0,0,1,0|2,0,0]=4 801 B12R1.511 NC1=CC(=C(C(=C1)O)Br)C(=O)O Z2755970277 [0,1,0,0,1,0|2,0,0]=4 802 B12R1.511 NC1=CC(=C(C(=C1)O)O)C(=O)O Z1262528593 [0,1,0,0,1,0|1,0,0]=3 803 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)Br)O Z104499292 [0,1,0,0,1,0|1,0,0]=3 804 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)Cl)F Z1450923305 [0,1,0,0,1,0|2,0,0]=4 805 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)Cl)O Z367679264 [0,1,0,0,1,0|1,0,0]=3 806 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)F)F Z1269159292 [0,1,0,0,1,0|2,0,0]=4 807 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)F)O Z367679340 [0,1,0,0,1,0|1,0,0]=3 808 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Br)I)F Z1450923060 [0,1,0,0,1,0|2,0,0]=4 809 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Br)F Z1416179586 [0,1,0,0,1,0|2,0,0]=4 810 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Br)O Z367679326 [0,1,0,0,1,0|1,0,0]=3 811 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)Br Z1269240944 [0,1,0,0,1,0|2,0,0]=4 812 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)Cl Z1269186387 [0,1,0,0,1,0|2,0,0]=4 813 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)F Z1450943906 [0,1,0,0,1,0|2,0,0]=4 814 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)I Z56893265 [0,1,0,0,1,0|2,0,0]=4 815 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)Cl)O Z111571460 [0,1,0,0,1,0|1,0,0]=3 816 B12R1.511 O=C(O)C1=C(C(=CC(=C1)Cl)F)Br Z1460683847 [0,1,0,0,1,0|2,0,0]=4 817 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Br)Cl Z2044800671 [0,1,0,0,1,0|2,0,0]=4 818 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Br)F Z1450923053 [0,1,0,0,1,0|2,0,0]=4 819 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Br)O Z367679328 [0,1,0,0,1,0|1,0,0]=3 820 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Cl)Br Z3239240815 [0,1,0,0,1,0|2,0,0]=4 821 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)Cl)O Z367679240 [0,1,0,0,1,0|1,0,0]=3 822 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)F)Br Z1269191925 [0,1,0,0,1,0|2,0,0]=4 823 B12R1.511 O=C(O)C1=C(C(=CC(=C1)F)F)O Z367679402 [0,1,0,0,1,0|1,0,0]=3 824 B12R1.511 O=C(O)C1=C(C(=CC(=C1)I)I)I Z104484766 [0,1,0,0,1,0|2,0,0]=4 825 B12R1.511 O=C(O)C1=C(C(=CC(=C1)I)I)O Z56957494 [0,1,0,0,1,0|1,0,0]=3 826 B12R1.511 O=C(O)C1=C(C(=CC(=C1)O)Cl)Cl Z2310950065 [0,1,0,0,1,0|1,0,0]=3 827 B12R1.894 CC1=C(C(=C(C=C1)Br)C(=O)O)F Z1322792919 [0,1,0,0,1,0|2,0,0]=4 828 B12R1.894 CC1=C(C(=C(C=C1)Br)C(=O)O)N Z443506424 [0,1,0,0,1,0|2,0,0]=4 829 B12R1.894 CC1=C(C(=C(C=C1)Br)F)C(=O)O Z1681354694 [0,1,0,0,1,0|2,0,0]=4 830 B12R1.894 CC1=C(C(=C(C=C1)Br)N)C(=O)O Z1541709093 [0,1,0,0,1,0|2,0,0]=4 831 B12R1.894 CC1=C(C(=C(C=C1)C)C(=O)O)N Z228589668 [0,1,0,0,1,0|2,0,0]=4 832 B12R1.894 CC1=C(C(=C(C=C1)C)C(=O)O)O Z367679246 [0,1,0,0,1,0|2,0,0]=4 833 B12R1.894 CC1=C(C(=C(C=C1)Cl)C(=O)O)N Z228589694 [0,1,0,0,1,0|2,0,0]=4 834 B12R1.894 CC1=C(C(=C(C=C1)Cl)C(=O)O)O Z1262539782 [0,1,0,0,1,0|2,0,0]=4 835 B12R1.894 CC1=C(C(=C(C=C1)Cl)F)C(=O)O Z1681354693 [0,1,0,0,1,0|2,0,0]=4 836 B12R1.894 CC1=C(C(=C(C=C1)Cl)N)C(=O)O Z1262534861 [0,1,0,0,1,0|2,0,0]=4 837 B12R1.894 CC1=C(C(=C(C=C1)Cl)O)C(=O)O Z979482256 [0,1,0,0,1,0|2,0,0]=4 838 B12R1.894 CC1=C(C(=C(C=C1)F)Br)C(=O)O Z1681347950 [0,1,0,0,1,0|2,0,0]=4 839 B12R1.894 CC1=C(C(=C(C=C1)F)C(=O)O)Br Z1496199175 [0,1,0,0,1,0|2,0,0]=4 840 B12R1.894 CC1=C(C(=C(C=C1)F)C(=O)O)F Z1201621151 [0,1,0,0,1,0|2,0,0]=4 841 B12R1.894 CC1=C(C(=C(C=C1)F)C(=O)O)N Z228589680 [0,1,0,0,1,0|2,0,0]=4 842 B12R1.894 CC1=C(C(=C(C=C1)F)C(=O)O)O Z1504689050 [0,1,0,0,1,0|2,0,0]=4 843 B12R1.894 CC1=C(C(=C(C=C1)F)O)C(=O)O Z1250417806 [0,1,0,0,1,0|2,0,0]=4 844 B12R1.894 CC1=C(C(=C(C=C1)N)C)C(=O)O Z1255401233 [0,1,0,0,1,0|2,0,0]=4 845 B12R1.894 CC1=C(C(=CC=C1Br)F)C(=O)O Z1681375384 [0,1,0,0,1,0|2,0,0]=4 846 B12R1.894 CC1=C(C(=CC=C1Br)N)C(=O)O Z1741785911 [0,1,0,0,1,0|2,0,0]=4 847 B12R1.894 CC1=C(C(=CC=C1F)Br)C(=O)O Z3300470140 [0,1,0,0,1,0|2,0,0]=4 848 B12R1.894 CC1=C(C(=CC=C1F)N)C(=O)O Z1889706206 [0,1,0,0,1,0|2,0,0]=4 849 B12R1.894 CC1=C(C(=NC=C1Br)O)C(=O)O Z2238621545 [0,1,0,0,1,0|2,0,0]=4 850 B12R1.894 NC1=C(C(=C(C=C1)Br)C(=O)O)F Z2750817919 [0,1,0,0,1,0|2,0,0]=4 851 B12R1.894 NC1=C(C(=C(C=C1)F)C(=O)O)Br Z2733331844 [0,1,0,0,1,0|2,0,0]=4 852 B12R1.894 NC1=C(C(=C(C=C1)F)C(=O)O)F Z1079174670 [0,1,0,0,1,0|2,0,0]=4 853 B12R1.894 NC1=C(C(=C(C=C1)F)F)C(=O)O Z4930347203 [0,1,0,0,1,0|2,0,0]=4 854 B12R1.894 NC1=C(C(=CC=C1Br)Br)C(=O)O Z819231154 [0,1,0,0,1,0|2,0,0]=4 855 B12R1.894 NC1=C(C(=CC=C1Br)Cl)C(=O)O Z1436569281 [0,1,0,0,1,0|2,0,0]=4 856 B12R1.894 NC1=C(C(=CC=C1Br)F)C(=O)O Z1411125255 [0,1,0,0,1,0|2,0,0]=4 857 B12R1.894 NC1=C(C(=CC=C1Cl)Br)C(=O)O Z1037549618 [0,1,0,0,1,0|2,0,0]=4 858 B12R1.894 NC1=C(C(=CC=C1Cl)F)C(=O)O Z1096175198 [0,1,0,0,1,0|2,0,0]=4 859 B12R1.894 NC1=C(C(=CC=C1F)Cl)C(=O)O Z228589720 [0,1,0,0,1,0|2,0,0]=4 860 B12R1.894 NC1=C(C(=CC=C1F)F)C(=O)O Z362758762 [0,1,0,0,1,0|2,0,0]=4 861 B12R1.894 NC1=C(C(=CC=C1O)Cl)C(=O)O Z1792270305 [0,1,0,0,1,0|1,0,0]=3 862 B12R1.894 O=C(O)C1=C(C(=CC=C1Br)F)I Z2755944611 [0,1,0,0,1,0|2,0,0]=4 863 B12R1.894 O=C(O)C1=C(C(=CC=C1Cl)Br)Cl Z1269185559 [0,1,0,0,1,0|2,0,0]=4 864 B12R1.894 O=C(O)C1=C(C(=CC=C1Cl)Cl)Cl Z56846824 [0,1,0,0,1,0|2,0,0]=4 865 B12R1.894 O=C(O)C1=C(C(=CC=C1Cl)O)Cl Z1269151644 [0,1,0,0,1,0|1,0,0]=3 866 B12R1.894 O=C(O)C1=C(C(=CC=C1F)Br)Cl Z1269114652 [0,1,0,0,1,0|2,0,0]=4 867 B12R1.894 O=C(O)C1=C(C(=CC=C1F)Br)F Z1269149081 [0,1,0,0,1,0|2,0,0]=4 868 B12R1.894 O=C(O)C1=C(C(=CC=C1F)Cl)Br Z2044785986 [0,1,0,0,1,0|2,0,0]=4 869 B12R1.894 O=C(O)C1=C(C(=CC=C1F)F)Br Z1269111638 [0,1,0,0,1,0|2,0,0]=4 870 B12R1.894 O=C(O)C1=C(C(=CC=C1F)F)Cl Z1201621189 [0,1,0,0,1,0|2,0,0]=4 871 B12R1.894 O=C(O)C1=C(C(=CC=C1F)I)Br Z2755944604 [0,1,0,0,1,0|2,0,0]=4 872 B12R1.894 O=C(O)C1=C(C(=CC=C1F)O)F Z1255490013 [0,1,0,0,1,0|1,0,0]=3 873 B12R1.894 O=C(O)C1=C(C(=CC=C1O)Br)Cl Z3300742760 [0,1,0,0,1,0|1,0,0]=3 874 B12R1.894 O=C(O)C1=C(C(=CC=C1O)Cl)F Z3243462448 [0,1,0,0,1,0|1,0,0]=3 875 B12R1.894 O=C(O)C1=C(C(=CC=C1O)Cl)O Z1198163198 [0,1,0,0,1,0|1,0,0]=3 876 B12R1.894 O=C(O)C1=C(C=CC(=C1Cl)Cl)I Z2755951032 [0,1,0,0,1,0|2,0,0]=4 877 B12R1.894 O=C(O)C1=C(C=CC(=C1Cl)F)I Z3300764149 [0,1,0,0,1,0|2,0,0]=4 878 B12R1.894 O=C(O)C1=C(C=CC(=C1F)Br)Cl Z1269156849 [0,1,0,0,1,0|2,0,0]=4 879 B12R1.894 O=C(O)C1=C(C=CC(=C1F)Br)I Z1269213730 [0,1,0,0,1,0|2,0,0]=4 880 B12R1.894 O=C(O)C1=C(C=CC(=C1F)Cl)Br Z1681374770 [0,1,0,0,1,0|2,0,0]=4 881 B12R1.894 O=C(O)C1=C(C=CC(=C1F)F)Cl Z1198172107 [0,1,0,0,1,0|2,0,0]=4 882 B12R1.894 O=C(O)C1=C(C=CC(=C1F)I)Cl Z2677803329 [0,1,0,0,1,0|2,0,0]=4 883 B12R1.894 O=C(O)C1=C(C=CC(=C1O)Cl)Cl Z367679284 [0,1,0,0,1,0|2,0,0]=4 884 B12R1.894 O=C(O)C1=C(C=CC(=C1O)F)F Z1117890950 [0,1,0,0,1,0|2,0,0]=4 885 B12R1.894 O=C(O)C1=C(C=CC(=C1O)O)F Z1198184434 [0,1,0,0,1,0|1,0,0]=3 886 B14R1.820 C=CC(=O)NCC1=C(C=CC(=C1)O)Cl Z3210940090 [0,1,0,0,0,1|2,0,0]=4 887 B14R1.820 COC(=O)COC1=C(C=CC(=C1)Cl)Cl Z14775249 [0,1,0,0,0,1|2,0,0]=4 888 B14R1.820 COC(=O)CSC1=C(C=CC(=C1)F)F Z92608912 [0,1,0,0,0,1|2,0,0]=4 889 B14R1.820 O=C(CCl)NCC1=C(C=CC(=C1)O)Cl Z3766263089 [0,1,0,0,0,1|2,0,0]=4 890 B14R1.1865 COC1=C(C=C(C=C1)Br)/C=C/C(=O)O Z2312258768 [0,1,0,0,0,1|1,0,1]=4 891 B14R1.1865 COC1=C(C=C(C=C1)Br)CCC(=O)O Z823820116 [0,1,0,0,0,1|1,0,0]=3 892 B14R1.1865 COC1=C(C=C(C=C1)Br)CNC(=O)C Z955369596 [0,1,0,0,0,1|2,0,0]=4 893 B14R1.1865 COC1=C(C=C(C=C1)C)/C=C/C(=O)O Z2312400653 [0,1,0,0,0,1|1,0,1]=4 894 B14R1.1865 COC1=C(C=C(C=C1)C)NCC(=O)N Z104846690 [0,1,0,0,0,1|2,0,0]=4 895 B14R1.1865 COC1=C(C=C(C=C1)Cl)/C=C/C(=O)O Z2942852108 [0,1,0,0,0,1|1,0,1]=4 896 B14R1.1865 COC1=C(C=C(C=C1)Cl)NCC(=O)N Z104662256 [0,1,0,0,0,1|2,0,0]=4 897 B14R1.1865 COC1=C(C=C(C=C1)Cl)NCC(=O)O Z359506144 [0,1,0,0,0,1|1,0,0]=3 898 B14R1.1865 COC1=C(C=C(C=C1)N)OCC(=O)N Z239873226 [0,1,0,0,0,1|2,0,0]=4 899 B14R1.4474 CC(SC1=C(C=CC(=C1)Cl)Cl)C(=O)O Z56279684 [0,1,0,0,0,1|2,0,0]=4 900 B14R1.4474 CC1=CC(=C(C=C1)Cl)OC(C)C(=O)O Z228583432 [0,1,0,0,0,1|2,0,0]=4 901 B14R1.4474 NC(CC1=C(C=CC(=C1)Cl)Cl)C(=O)O Z5010675411 [0,1,0,0,0,1|2,0,0]=4 902 B14R1.6036 CC1=C(C=C(C(=C1)Cl)O)OCC(=O)O Z1209414410 [0,1,0,0,0,1|1,0,0]=3 903 B14R1.6036 CC1=CC(=C(C=C1SCC(=O)O)C)Br Z56779304 [0,1,0,0,0,1|2,0,0]=4 904 B14R1.6036 O=C(O)COC1=C(C=C(C(=C1)Cl)Cl)Cl Z57048946 [0,1,0,0,0,1|2,0,0]=4 905 B14R1.881 COC1=C(C=C(C(=C1)CC(=O)O)F)O Z1416167707 [0,2,0,0,0,0|1,0,0]=3 906 B14R1.881 COC1=CN(C(=CC1=O)C)CC(=O)O Z1262530358 [0,2,0,0,0,0|2,0,0]=4 907 B14R1.3723 COC1=CC(=C(C=C1)OC)CC(=O)O Z104495790 [0,2,0,0,0,0|0,0,0]=2 908 B14R1.3724 COC(=O)CC1=C(C=CC(=C1)C=O)F Z2310986099 [0,2,0,0,0,0|1,0,1]=4 909 B14R1.2284 COC1=C(C=C(C(=C1)C)CC(=O)O)F Z3243603313 [0,2,0,0,0,0|2,0,0]=4 910 B14R1.2284 COC1=C(C=C(C(=C1)Cl)CC(=O)O)F Z3325825930 [0,2,0,0,0,0|2,0,0]=4 911 B14R1.3143 CC1=CC(=C(C(=C1CC(=O)O)C)Br)C Z1618132695 [0,2,0,0,0,0|2,0,0]=4 912 B14R1.3143 O=C(O)CC1=C(C(=C(C=C1F)F)Br)F Z2311151896 [0,2,0,0,0,0|2,0,0]=4 913 B14R1.6038 O=C(O)C(O)C1=C(C=C(C(=C1)F)F)F Z1269165997 [0,2,0,0,0,0|2,0,0]=4 914 B14R1.988 COC(=O)C(N)C1=C(C=CC(=C1)F)F Z1262398431 [0,2,0,0,0,0|2,0,0]=4 915 B14R1.1008 CNC(C(=O)O)C1=C(C=CC(=C1)F)F Z446010990 [0,2,0,0,0,0|2,0,0]=4 916 B14R1.1008 NCC(C(=O)O)C1=C(C=CC(=C1)F)F Z3814757614 [0,2,0,0,0,0|2,0,0]=4 917 B14R1.1867 COC1=C(C=C(C=C1)Br)C(=O)C(=O)O Z234897343 [0,2,0,0,0,0|1,0,1]=4 918 B14R1.1867 COC1=C(C=C(C=C1)Br)C(N)C(=O)O Z381382766 [0,2,0,0,0,0|1,0,0]=3 919 B14R1.1867 COC1=C(C=C(C=C1)F)C(=O)C(=O)O Z234897345 [0,2,0,0,0,0|1,0,1]=4 920 B14R1.1867 COC1=C(C=C(C=C1)F)C(N)C(=O)O Z2186882893 [0,2,0,0,0,0|1,0,0]=3 921 B14R1.4471 CC(C)(C(=O)O)C1=C(C=CC(=C1)Br)F Z1269152429 [0,2,0,0,0,0|2,0,0]=4 922 B14R1.4471 CC(N)(C(=O)O)C1=C(C=CC(=C1)Br)F Z1269144569 [0,2,0,0,0,0|2,0,0]=4 923 B14R1.4471 CC(N)(C(=O)O)C1=C(C=CC(=C1)F)F Z317024830 [0,2,0,0,0,0|2,0,0]=4 924 B14R1.4471 CC1=C(C=C(C=C1)F)C(F)(F)C(=O)O Z982129406 [0,2,0,0,0,0|2,0,0]=4 925 B14R1.4471 O=C(O)C(F)(F)C1=C(C=CC(=C1)Cl)Cl Z982129430 [0,2,0,0,0,0|2,0,0]=4 926 B14R1.4471 O=C(O)C(F)(F)C1=C(C=CC(=C1)F)F Z1020793976 [0,2,0,0,0,0|2,0,0]=4 927 B14R1.950 COCC(=O)NC1=C(C=CC(=C1)Cl)O Z69138118 [0,2,0,0,0,0|2,0,0]=4 928 B14R1.3279 CNC(=O)CC1=C(C=CC(=C1)C)OC Z183857068 [0,2,0,0,0,0|2,0,0]=4 929 B14R1.3279 CNC(=O)CC1=C(C=CC(=C1)Cl)OC Z166966948 [0,2,0,0,0,0|2,0,0]=4 930 B14R1.3279 CNC(=O)CC1=C(C=CC(=C1)F)OC Z1730696665 [0,2,0,0,0,0|2,0,0]=4 931 B14R1.3279 COC(=O)CC1=C(C=CC(=C1)Br)C#N Z1269239243 [0,2,0,0,0,0|2,0,0]=4 932 B14R1.164 CC(C)C1=C(C=C(C=C1)F)CC(=O)O Z3243602453 [0,2,0,0,0,0|2,0,0]=4 933 B14R1.164 O=C(O)CC1=C(C=CC(=C1)Br)C(=O)O Z1258932136 [0,2,0,0,0,0|1,0,0]=3 934 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [0,0,1,1,0,0|1,0,1]=4 935 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,0,1,1,0,0|1,0,1]=4 936 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,0,1,1,0,0|2,0,0]=4 937 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,0,1,1,0,0|2,0,0]=4 938 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,0,1,1,0,0|2,0,0]=4 939 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O Z56347225 [0,0,1,1,0,0|1,0,1]=4 940 B12R1.125 O=C(O)COC1=C(C=CC=C1)O Z56869464 [0,0,1,1,0,0|2,0,0]=4 941 B12R1.125 O=C(O)CSC1=C(C=CC=C1)O Z905204160 [0,0,1,1,0,0|2,0,0]=4 942 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [1,0,0,1,0,0|2,0,0]=4 943 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 Z1255486033 [1,0,0,1,0,0|1,0,0]=3 944 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 Z104495562 [1,0,0,1,0,0|2,0,0]=4 945 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [1,0,0,1,0,0|2,0,0]=4 946 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [1,0,0,1,0,0|2,0,0]=4 947 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [1,0,0,1,0,0|2,0,0]=4 948 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [1,0,0,1,0,0|2,0,0]=4 949 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [1,0,0,1,0,0|1,0,0]=3 950 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [1,0,0,1,0,0|2,0,0]=4 951 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [1,0,0,1,0,0|2,0,0]=4 952 B12R2.202 OC1=C2N=C(OC2=CC=C1)S Z3235037659 [1,0,0,1,0,0|1,1,0]=4 953 B12R2.202 OC1=CC=CC2=C1N=C(O2)O Z1322795564 [1,0,0,1,0,0|1,0,1]=4 954 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [1,0,0,1,0,0|2,0,0]=4 955 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [1,0,0,1,0,0|1,0,1]=4 956 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [1,0,0,1,0,0|2,0,0]=4 957 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [1,0,0,1,0,0|2,0,0]=4 958 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [1,0,0,1,0,0|2,0,0]=4 959 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [1,0,0,1,0,0|2,0,0]=4 960 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [1,0,0,1,0,0|2,0,0]=4 961 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [1,0,0,1,0,0|2,0,0]=4 962 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [1,0,0,1,0,0|1,0,0]=3 963 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [1,0,0,1,0,0|2,0,0]=4 964 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [1,0,0,1,0,0|2,0,0]=4 965 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [1,0,0,1,0,0|2,0,0]=4 966 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [1,0,0,1,0,0|1,0,0]=3 967 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [1,0,0,1,0,0|2,0,0]=4 968 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [1,0,0,1,0,0|1,0,0]=3 969 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [1,0,0,1,0,0|1,0,0]=3 970 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [1,0,0,1,0,0|1,1,0]=4 971 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [1,0,0,1,0,0|1,0,1]=4 972 B12R2.221 OC1=C2CCOC2=C(C=C1)F Z1255367770 [1,0,0,1,0,0|1,0,1]=4 973 B12R2.132 CC1=CC2=C(C=C1)COC2=O Z1255391985 [0,0,0,1,1,0|2,0,0]=4 974 B12R2.132 NC1=CC2=C(C=C1)COC2=O Z276599558 [0,0,0,1,1,0|2,0,0]=4 975 B12R2.132 O=C1COC2=C1C=C(C=C2)Cl Z334863058 [0,0,0,1,1,0|2,0,0]=4 976 B12R2.132 O=C1COC2=C1C=C(C=C2)F Z334863052 [0,0,0,1,1,0|2,0,0]=4 977 B12R2.132 O=C1NCC2=C1C=C(C=C2)O Z1198177071 [0,0,0,1,1,0|2,0,0]=4 978 B12R2.132 O=C1OCC2=C1C=C(C=C2)Br Z1258932820 [0,0,0,1,1,0|2,0,0]=4 979 B12R2.132 O=C1OCC2=C1C=C(C=C2)F Z1198309551 [0,0,0,1,1,0|2,0,0]=4 980 B12R2.132 O=C1OCC2=C1C=C(C=C2)O Z1198181162 [0,0,0,1,1,0|1,0,0]=3 981 B12R2.132 OC1=CC2=C(C=C1)OC=C2O Z1216838816 [0,0,0,1,1,0|1,0,0]=3 982 B12R2.132 OC1=NOC2=C1C=C(C=C2)Cl Z1201619168 [0,0,0,1,1,0|2,0,0]=4 983 B14R2.4529 CC1=CC2=C(C=C1)CC(S2)C(=O)O Z223677100 [0,0,0,1,0,1|2,0,0]=4 984 B14R2.4529 CC1=CC2=C(C=C1)OC(=C2)C(=O)O Z274568060 [0,0,0,1,0,1|1,0,1]=4 985 B14R2.4529 NC(=O)C1=NC2=C(O1)C=CC(=C2)O Z2311082108 [0,0,0,1,0,1|1,0,1]=4 986 B14R2.4529 NC(=O)C1CC2=C(O1)C=CC(=C2)N Z4762517556 [0,0,0,1,0,1|2,0,0]=4 987 B14R2.4529 NC1=CC2=C(C=C1)NC(C2)C(=O)O Z3325140518 [0,0,0,1,0,1|2,0,0]=4 988 B14R2.4529 NC1=CC2=C(C=C1)OC(=C2)C(=O)O Z426041472 [0,0,0,1,0,1|1,0,1]=4 989 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)O Z2894427530 [0,0,0,1,0,1|1,0,1]=4 990 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)Br Z111570846 [0,0,0,1,0,1|1,0,1]=4 991 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)Cl Z104341200 [0,0,0,1,0,1|1,0,1]=4 992 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)F Z979493270 [0,0,0,1,0,1|1,0,1]=4 993 B14R2.4529 O=C(O)C1CC2=C(C1)C=C(C=C2)F Z1262528526 [0,0,0,1,0,1|2,0,0]=4 994 B14R2.4529 O=C(O)C1CC2=C(O1)C=C(C=C2)Br Z2751941707 [0,0,0,1,0,1|2,0,0]=4 995 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)Br Z1269223909 [0,0,0,1,0,1|1,0,0]=3 996 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)Cl Z104341198 [0,0,0,1,0,1|1,0,0]=3 997 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 Z1255485170 [0,1,0,1,0,0|2,0,0]=4 998 B14R2.134 COC1=CC2=C(C=C1)OCC(=O)N2 Z1198176733 [0,1,0,1,0,0|2,0,0]=4 999 B14R2.7933 O=C(O)C1CC2=C1C=C(C(=C2)F)O Z4959121917 [0,1,0,1,0,0|1,0,0]=3 1000 B14R2.5816 CC1=CC2=C(C=C1)OC=C2C(=O)O Z1262557910 [0,1,0,1,0,0|1,0,1]=4 1001 B14R2.5816 O=C(O)C1=COC2=C1C=C(C=C2)Br Z1267805736 [0,1,0,1,0,0|1,0,1]=4 1002 B14R2.5816 O=C(O)C1=COC2=C1C=C(C=C2)F Z1262556214 [0,1,0,1,0,0|1,0,1]=4 1003 B14R2.5816 O=C(O)C1=COC2=C1C=C(C=C2)O Z1255392768 [0,1,0,1,0,0|0,0,1]=3 1004 B14R2.5816 O=C(O)C1=NOC2=C1C=C(C=C2)Br Z1269159549 [0,1,0,1,0,0|1,0,1]=4 1005 B14R2.5816 O=C(O)C1=NOC2=C1C=C(C=C2)Cl Z2732748776 [0,1,0,1,0,0|1,0,1]=4 1006 B14R2.5816 O=C(O)C1CCC2=C1C=C(C=C2)Br Z1269194102 [0,1,0,1,0,0|2,0,0]=4 1007 B14R2.5816 O=C(O)C1COC2=C1C=C(C=C2)Br Z1269233195 [0,1,0,1,0,0|1,0,0]=3 1008 B14R2.5816 O=C(O)C1COC2=C1C=C(C=C2)Cl Z1198276236 [0,1,0,1,0,0|1,0,0]=3 1009 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [1,0,0,0,1,0|2,0,0]=4 1010 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [1,0,0,0,1,0|2,0,0]=4 1011 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [1,0,0,0,1,0|2,0,0]=4 1012 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [1,0,0,0,1,0|2,0,0]=4 1013 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [1,0,0,0,1,0|1,0,0]=3 1014 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [1,0,0,0,1,0|2,0,0]=4 1015 B10R1.61 CC(=O)C1=C(C=NC=C1)O Z1255445560 [1,0,0,0,1,0|2,0,0]=4 1016 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [1,0,0,0,1,0|1,0,0]=3 1017 B10R1.61 CC1=C(C=CC=N1)C(=O)O Z1276602308 [1,0,0,0,1,0|2,0,0]=4 1018 B10R1.61 CC1=C(C=CN=C1)C(=O)O Z1708090074 [1,0,0,0,1,0|2,0,0]=4 1019 B10R1.61 CC1=C(C=NC=C1)C(=O)O Z199468010 [1,0,0,0,1,0|2,0,0]=4 1020 B10R1.61 CC1=C(N=CC=C1)C(=O)O Z976634736 [1,0,0,0,1,0|2,0,0]=4 1021 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [1,0,0,0,1,0|2,0,0]=4 1022 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [1,0,0,0,1,0|2,0,0]=4 1023 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [1,0,0,0,1,0|2,0,0]=4 1024 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [1,0,0,0,1,0|2,0,0]=4 1025 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [1,0,0,0,1,0|2,0,0]=4 1026 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [1,0,0,0,1,0|1,0,0]=3 1027 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [1,0,0,0,1,0|2,0,0]=4 1028 B10R1.61 NC1=C(C=CC=N1)C(=O)O Z104475724 [1,0,0,0,1,0|2,0,0]=4 1029 B10R1.61 NC1=C(C=CN=C1)C(=O)O Z414314668 [1,0,0,0,1,0|2,0,0]=4 1030 B10R1.61 NC1=C(C=NC=C1)C(=O)O Z1167043563 [1,0,0,0,1,0|2,0,0]=4 1031 B10R1.61 NC1=C(N=CC=C1)C(=O)O Z1201619040 [1,0,0,0,1,0|2,0,0]=4 1032 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [1,0,0,0,1,0|1,0,0]=3 1033 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [1,0,0,0,1,0|1,0,0]=3 1034 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [1,0,0,0,1,0|1,0,0]=3 1035 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [1,0,0,0,1,0|1,0,0]=3 1036 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [1,0,0,0,1,0|0,0,0]=2 1037 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [1,0,0,0,1,0|0,1,0]=3 1038 B10R1.61 O=C(O)C1=C(C=CC=N1)Cl Z1203161828 [1,0,0,0,1,0|2,0,0]=4 1039 B10R1.61 O=C(O)C1=C(C=CC=N1)O Z608353738 [1,0,0,0,1,0|1,0,0]=3 1040 B10R1.61 O=C(O)C1=C(C=NC=C1)Br Z1238800040 [1,0,0,0,1,0|2,0,0]=4 1041 B10R1.61 O=C(O)C1=C(C=NC=C1)Cl Z1255387391 [1,0,0,0,1,0|2,0,0]=4 1042 B10R1.61 O=C(O)C1=C(C=NC=C1)F Z1270326283 [1,0,0,0,1,0|2,0,0]=4 1043 B10R1.61 O=C(O)C1=C(C=NC=C1)I Z1269217659 [1,0,0,0,1,0|2,0,0]=4 1044 B10R1.61 O=C(O)C1=C(N=CC=C1)Br Z926900218 [1,0,0,0,1,0|2,0,0]=4 1045 B10R1.61 O=C(O)C1=C(N=CC=C1)Cl Z104474538 [1,0,0,0,1,0|2,0,0]=4 1046 B10R1.61 O=C(O)C1=C(N=CC=C1)F Z1203161997 [1,0,0,0,1,0|2,0,0]=4 1047 B10R1.61 O=C(O)C1=C(N=CC=C1)I Z1269167145 [1,0,0,0,1,0|2,0,0]=4 1048 B10R1.61 O=C(O)C1=C(N=CC=C1)S Z203045100 [1,0,0,0,1,0|1,1,0]=4 1049 B10R1.61 O=C(O)C1=CC=CNC1=O Z57012260 [1,0,0,0,1,0|1,0,1]=4 1050 B10R1.61 O=C(O)C1=CNC=CC1=O Z1869802012 [1,0,0,0,1,0|1,0,1]=4 1051 B10R1.61 O=C(O)C1=[N+](C=CC=C1)[O-] Z147642478 [1,0,0,0,1,0|1,0,1]=4 1052 B10R1.61 OB(O)C1=C(C=CC=C1)O Z1201620791 [1,0,0,0,1,0|1,0,1]=4 1053 B10R1.64 CC1=C(SC=C1)CC(=O)O Z978942584 [1,0,0,0,1,0|2,0,0]=4 1054 B10R1.64 O=C(O)CC1=C(C=CS1)Br Z854068742 [1,0,0,0,1,0|2,0,0]=4 1055 B10R1.64 O=C(O)CC1=C(SC=C1)Br Z1416196048 [1,0,0,0,1,0|2,0,0]=4 1056 B10R1.64 O=C(O)CC1=CSC=C1F Z2311011512 [1,0,0,0,1,0|2,0,0]=4 1057 B10R1.54 CC1=CC=C(O1)CC(=O)O Z978942572 [1,0,0,0,1,0|2,0,0]=4 1058 B10R1.54 CC1=CC=C(S1)CC(=O)O Z362118824 [1,0,0,0,1,0|2,0,0]=4 1059 B10R1.54 CC1=CSC(=C1)CC(=O)O Z1255506269 [1,0,0,0,1,0|2,0,0]=4 1060 B10R1.54 O=C(O)CC1=CC=C(S1)Cl Z285575844 [1,0,0,0,1,0|2,0,0]=4 1061 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,0,0,0,1,0|2,0,0]=4 1062 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,0,0,0,1,0|2,0,0]=4 1063 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,0,0,0,1,0|2,0,0]=4 1064 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,0,0,0,1,0|2,0,0]=4 1065 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [1,0,0,0,1,0|1,0,1]=4 1066 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,0,0,0,1,0|2,0,0]=4 1067 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,0,0,0,1,0|1,0,0]=3 1068 B10R1.113 CC1=CC(=CN=C1)C(=O)O Z825019000 [1,0,0,0,1,0|2,0,0]=4 1069 B10R1.113 CC1=NC(=CC=C1)C(=O)O Z278017928 [1,0,0,0,1,0|2,0,0]=4 1070 B10R1.113 CC1=NC=CC(=C1)C(=O)O Z1205493663 [1,0,0,0,1,0|2,0,0]=4 1071 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [1,0,0,0,1,0|1,0,1]=4 1072 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [1,0,0,0,1,0|1,0,1]=4 1073 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,0,0,0,1,0|2,0,0]=4 1074 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,0,0,0,1,0|2,0,0]=4 1075 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,0,0,0,1,0|2,0,0]=4 1076 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,0,0,0,1,0|2,0,0]=4 1077 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,0,0,0,1,0|2,0,0]=4 1078 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,0,0,0,1,0|1,0,0]=3 1079 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,0,0,0,1,0|1,1,0]=4 1080 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [1,0,0,0,1,0|2,0,0]=4 1081 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,0,0,0,1,0|1,0,0]=3 1082 B10R1.113 NC1=CC(=CN=C1)C(=O)O Z1095353978 [1,0,0,0,1,0|2,0,0]=4 1083 B10R1.113 NC1=CC(=NC=C1)C(=O)O Z381413014 [1,0,0,0,1,0|2,0,0]=4 1084 B10R1.113 NC1=NC(=CC=C1)C(=O)O Z220336222 [1,0,0,0,1,0|2,0,0]=4 1085 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,0,0,0,1,0|1,0,0]=3 1086 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,0,0,0,1,0|1,0,0]=3 1087 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,0,0,0,1,0|1,0,0]=3 1088 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,0,0,0,1,0|1,0,0]=3 1089 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,0,0,0,1,0|0,0,0]=2 1090 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,0,0,0,1,0|0,1,0]=3 1091 B10R1.113 O=C(O)C1=CC(=CN=C1)Br Z104476582 [1,0,0,0,1,0|2,0,0]=4 1092 B10R1.113 O=C(O)C1=CC(=CN=C1)Cl Z972756276 [1,0,0,0,1,0|2,0,0]=4 1093 B10R1.113 O=C(O)C1=CC(=CN=C1)F Z1192357288 [1,0,0,0,1,0|2,0,0]=4 1094 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [1,0,0,0,1,0|1,0,0]=3 1095 B10R1.113 O=C(O)C1=CC(=CN=C1)S Z2238935068 [1,0,0,0,1,0|1,1,0]=4 1096 B10R1.113 O=C(O)C1=CC(=NC=C1)Br Z1259086653 [1,0,0,0,1,0|2,0,0]=4 1097 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl Z135302154 [1,0,0,0,1,0|2,0,0]=4 1098 B10R1.113 O=C(O)C1=CC(=NC=C1)F Z234896331 [1,0,0,0,1,0|2,0,0]=4 1099 B10R1.113 O=C(O)C1=CC(=NC=C1)S Z800150220 [1,0,0,0,1,0|1,1,0]=4 1100 B10R1.113 O=C(O)C1=C[N+](=CC=C1)[O-] Z104477974 [1,0,0,0,1,0|1,0,1]=4 1101 B10R1.113 O=C(O)C1=NC(=CC=C1)Br Z415628156 [1,0,0,0,1,0|2,0,0]=4 1102 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [1,0,0,0,1,0|2,0,0]=4 1103 B10R1.113 O=C(O)C1=NC(=CC=C1)F Z1203162000 [1,0,0,0,1,0|2,0,0]=4 1104 B10R1.113 O=C(O)C1=NC=CC(=C1)Br Z802558860 [1,0,0,0,1,0|2,0,0]=4 1105 B10R1.113 O=C(O)C1=NC=CC(=C1)Cl Z57990012 [1,0,0,0,1,0|2,0,0]=4 1106 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [1,0,0,0,1,0|1,0,0]=3 1107 B10R1.113 O=C1C=C(C=CN1)C(=O)O Z1416200909 [1,0,0,0,1,0|1,0,1]=4 1108 B10R1.113 O=C1C=CC=C(N1)C(=O)O Z359371306 [1,0,0,0,1,0|1,0,1]=4 1109 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [1,0,0,0,1,0|1,0,1]=4 1110 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,0,0,0,1,0|1,0,1]=4 1111 B10R1.113 OB(O)C1=CC(=CC=C1)O Z336080002 [1,0,0,0,1,0|1,0,1]=4 1112 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C Z406376778 [1,0,0,0,0,1|2,0,0]=4 1113 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F Z406376716 [1,0,0,0,0,1|2,0,0]=4 1114 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br Z340632658 [1,0,0,0,0,1|2,0,0]=4 1115 B12R1.226 CC(=O)NCC1=CC(=CC=C1)F Z340527618 [1,0,0,0,0,1|2,0,0]=4 1116 B12R1.226 CC1=CC(=CC=C1)/C=C/C(=O)O Z2942851787 [1,0,0,0,0,1|1,0,1]=4 1117 B12R1.226 CC1=CC(=CC=C1)CCC(=O)N Z194976514 [1,0,0,0,0,1|2,0,0]=4 1118 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O Z169993866 [1,0,0,0,0,1|1,0,0]=3 1119 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [1,0,0,0,0,1|2,0,0]=4 1120 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N Z19732960 [1,0,0,0,0,1|2,0,0]=4 1121 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O Z56899056 [1,0,0,0,0,1|1,0,0]=3 1122 B12R1.226 CC1=CC(=CC=C1)SCC(=O)O Z778642574 [1,0,0,0,0,1|1,0,0]=3 1123 B12R1.226 NC(=O)CCC1=CC(=CC=C1)N Z414316850 [1,0,0,0,0,1|2,0,0]=4 1124 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [1,0,0,0,0,1|2,0,0]=4 1125 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [1,0,0,0,0,1|2,0,0]=4 1126 B12R1.226 NC(=O)COC1=CC(=CC=C1)F Z19755608 [1,0,0,0,0,1|2,0,0]=4 1127 B12R1.226 NC(=O)COC1=CC(=CC=C1)I Z25076202 [1,0,0,0,0,1|2,0,0]=4 1128 B12R1.226 NC(=O)COC1=CC(=CC=C1)N Z235344273 [1,0,0,0,0,1|2,0,0]=4 1129 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [1,0,0,0,0,1|1,0,0]=3 1130 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [1,0,0,0,0,1|2,0,0]=4 1131 B12R1.226 NC1=CC(=CC=C1)/C=C/C(=O)O Z2942853438 [1,0,0,0,0,1|1,0,1]=4 1132 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Br Z2312942093 [1,0,0,0,0,1|1,0,1]=4 1133 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Cl Z2573655238 [1,0,0,0,0,1|1,0,1]=4 1134 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)F Z2935925467 [1,0,0,0,0,1|1,0,1]=4 1135 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O Z247613734 [1,0,0,0,0,1|0,0,1]=3 1136 B12R1.226 O=C(O)/C=C/C1=CC(=CN=C1)O Z1518653071 [1,0,0,0,0,1|1,0,1]=4 1137 B12R1.226 O=C(O)/C=C/C1=CC(=NC=C1)O Z2633787192 [1,0,0,0,0,1|1,0,1]=4 1138 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)Cl Z1143242523 [1,0,0,0,0,1|1,0,1]=4 1139 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br Z56943439 [1,0,0,0,0,1|1,0,0]=3 1140 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F Z185153196 [1,0,0,0,0,1|1,0,0]=3 1141 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [1,0,0,0,0,1|0,0,0]=2 1142 B12R1.226 O=C(O)CCC1=CC(=CN=C1)F Z1262517660 [1,0,0,0,0,1|2,0,0]=4 1143 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O Z1504676734 [1,0,0,0,0,1|1,0,0]=3 1144 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl Z274534700 [1,0,0,0,0,1|1,0,0]=3 1145 B12R1.226 O=C(O)COC1=CC(=CC=C1)Br Z56812737 [1,0,0,0,0,1|1,0,0]=3 1146 B12R1.226 O=C(O)COC1=CC(=CC=C1)Cl Z57008935 [1,0,0,0,0,1|1,0,0]=3 1147 B12R1.226 O=C(O)COC1=CC(=CN=C1)Br Z1206892989 [1,0,0,0,0,1|2,0,0]=4 1148 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Br Z255149890 [1,0,0,0,0,1|1,0,0]=3 1149 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Cl Z994465872 [1,0,0,0,0,1|1,0,0]=3 1150 B12R1.226 O=C(O)CSC1=CC(=CC=C1)F Z1198220671 [1,0,0,0,0,1|1,0,0]=3 1151 B12R1.226 O=C(O)CSC1=CC(=CC=C1)O Z1262555002 [1,0,0,0,0,1|0,0,0]=2 1152 B14R1.6072 CC1=CC(=C(C=C1)C)OCCC(=O)O Z56889404 [0,0,0,0,0,2|2,0,0]=4 1153 B14R1.6072 CC1=CC(=C(C=C1)N)SCCC(=O)O Z1675167240 [0,0,0,0,0,2|2,0,0]=4 1154 B14R1.6072 O=C(O)CCCC1=C(C=CC(=C1)F)F Z336285978 [0,0,0,0,0,2|2,0,0]=4 1155 B14R1.6072 O=C(O)CCOC1=C(C=CC(=C1)Cl)Cl Z223959282 [0,0,0,0,0,2|2,0,0]=4 1156 B14R1.6072 O=C(O)CCOC1=C(C=CC(=C1)F)F Z1117890484 [0,0,0,0,0,2|2,0,0]=4 1157 B14R1.6072 O=C(O)CCSC1=C(C=CC(=C1)F)F Z103335878 [0,0,0,0,0,2|2,0,0]=4